Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.64 |
| ▸ | CES2 | O00748 | 1/20 | 0.62 |
| ▸ | CES1 | P23141 | 1/20 | 0.62 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.58 |
| ▸ | CHRNG | P07510 | 1/20 | 0.58 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.58 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.58 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | CHRND | Q07001 | 1/20 | 0.58 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.54 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.54 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | STS | P08842 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7427631 | 0.86 | CES2 (0.67) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL5218170 | 0.86 | CES2 (0.67) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL11982376 | 0.85 | PARP1 (0.45) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL27749768 | 0.85 | PARP1 (0.62) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL15007434 | 0.84 | CES2 (0.65) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL20090393 | 0.84 | CES2 (0.65) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL2599155 | 0.84 | CES2 (0.65) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL9366959 | 0.83 | CES2 (0.62) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL1358606 | 0.83 | CES2 (0.62) | PARP1CES2CES1CHRNA1CHRNG | |
| SCHEMBL1164163 | 0.82 | CES2 (0.67) | PARP1CES2CES1CHRNA1CHRNG |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3083986-A | — | — | None | — | — | JP | 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 |
| EP-0471358-B1 | Fluoroethylcamptothecin derivatives | KYORIN SEIYAKU KK (JP) | 1996-05-08 | — | — | EP | 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 |
| EP-0471358-A1 | Fluoroethylcamptothecin derivatives | KYORIN PHARMACEUTICAL CO., LTD. (JP) | 1992-02-19 | — | — | EP | disclosed |
| EP-0220601-B1 | PYRANOINDOLIZINE DERIVATIVES AND PREPARATION PROCESS THEREOF | DAIICHI SEIYAKU CO., LTD. (JP) | 1991-12-11 | — | — | EP | disclosed |
| JP-H0383986-A | NEW QUINOLINE DERIVATIVE AND ITS PRODUCTION | YAKULT HONSHA CO LTD | 1991-04-09 | — | — | JP | disclosed |
| US-4778891-A | Certain pyrano (3,4-f)-indolizine derivatives | DAIICHI SEIYAKU CO., LTD. (JP) | 1988-10-18 | — | — | US | disclosed |
| EP-0220601-A1 | Pyranoindolizine derivatives and preparation process thereof | DAIICHI SEIYAKU CO., LTD. (JP) | 1987-05-06 | — | — | EP | disclosed |