Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.56 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.56 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.56 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.56 |
| ▸ | FAAH | O00519 | 1/20 | 0.56 |
| ▸ | ELANE | P08246 | 1/20 | 0.56 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | MMP1 | P03956 | 1/20 | 0.56 |
| ▸ | MMP2 | P08253 | 1/20 | 0.56 |
| ▸ | MMP9 | P14780 | 1/20 | 0.56 |
| ▸ | MMP8 | P22894 | 1/20 | 0.56 |
| ▸ | MMP13 | P45452 | 1/20 | 0.56 |
| ▸ | F2 | P00734 | 2/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Phenylmethanesulfonic Acid SCHEMBL30217949 | 0.97 | CA2 (0.58) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL28294303 | 0.97 | CA2 (0.58) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL1749 | 0.97 | CA2 (0.58) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL127384 | 0.97 | CA2 (0.58) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL3917283 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL11411737 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL5399345 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL7812774 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL21811372 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL1614254 | 0.95 | CA2 (0.56) | CA2PRSS1PRSS2PRSS3CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2849568-A1 | PROCESS FOR MAKING CGRP RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2015-03-25 | — | — | EP | disclosed |
| EP-2686401-A1 | MESOGEN-CONTAINING COMPOUNDS | Transitions Optical, Inc. (US) | 2014-01-22 | — | — | EP | disclosed |
| WO-2013169348-A1 | PROCESS FOR MAKING CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2013-11-14 | — | — | WO | disclosed |
| WO-2012128944-A1 | MESOGEN-CONTAINING COMPOUNDS | TRANSITIONS OPTICAL, INC. (US) | 2012-09-27 | — | — | WO | disclosed |
| EP-2035566-A2 | MATERIALS AND COMPLEXES FOR THE DELIVERY OF BIOLOGICALLY-ACTIVE MATERIAL TO CELLS | University College London (GB) | 2009-03-18 | — | — | EP | disclosed |
| WO-2007138324-A2 | MATERIALS AND COMPLEXES FOR THE DELIVERY OF BIOLOGICALLY-ACTIVE MATERIAL TO CELLS | UNIVERSITY COLLEGE LONDON (GB) | 2007-12-06 | — | — | WO | disclosed |
| EP-1077959-A1 | MORPHOLINO ETHERS | Glaxo Wellcome S.A. (ES) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999058512-A1 | MORPHOLINO ETHERS | GLAXO WELLCOME S.A. (ES) | 1999-11-18 | — | — | WO | disclosed |
| US-5949130-A | Semiconductor integrated circuit device employing interlayer insulating film with low dielectric constant | FUJITSU LIMITED (JP) | 1999-09-07 | — | — | US | disclosed |
| US-5541327-A | Preparation of camptothecin analogs | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-07-30 | — | — | US | disclosed |
| US-5525731-A | CYCLIZATION; HALOGENATION; ALKYLATION; REDUCTION; HYDROLYSIS; DECARBOXYLATION; SELENYLATION | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-06-11 | — | — | US | disclosed |
| US-5446047-A | Anticancer agents | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1995-08-29 | — | — | US | disclosed |
| US-5391745-A | Cytotoxic activity towards cancer cells | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1995-02-21 | — | — | US | disclosed |
| WO-1994011376-A1 | CAMPTOTHECIN ANALOGUES AND METHODS OF PREPARATION THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1994-05-26 | — | — | WO | disclosed |