Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA6 | P23280 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | TPMT | P51580 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | RARA | P10276 | 1/20 | 0.45 |
| ▸ | RARB | P10826 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9036638 | 0.98 | CA12 (0.51) | CA12CA1CA2CA4CA6 | |
| SCHEMBL8156878 | 0.88 | ALDH1A1 (0.43) | HTTLMNAMAPK1TSHRHSD17B10 | |
| SCHEMBL4946900 | 0.76 | KDM4E (0.70) | CA12CA1CA2CA4CA6 | |
| SCHEMBL2671576 | 0.76 | KDM4E (0.54) | CA12CA1CA2CA4CA6 | |
| SCHEMBL22672508 | 0.75 | TDP1 (0.54) | CA12CA1CA2CA4CA6 | |
| SCHEMBL13230262 | 0.73 | BACE1 (0.43) | RAB9AHTTKDM4EPDGFRBPDGFRA | |
| SCHEMBL360580 | 0.73 | KDM4E (0.60) | CA12CA1CA2CA4CA6 | |
| SCHEMBL9319496 | 0.72 | KDM4E (0.57) | CA12CA1CA2CA4CA6 | |
| SCHEMBL8155683 | 0.72 | UGT2B7 (0.42) | HTTLMNAPDGFRBPDGFRATSHR | |
| SCHEMBL8148257 | 0.72 | CYP2A6 (0.44) | RAB9AHTTLMNAMAPK1KDM4E |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103601674-B | A kind of suppress dipeptides kininase compound and preparation method and purposes | ZHEJIANG UNIVERSITY (CN) | 2015-09-23 | — | — | CN | disclosed |
| CN-1350524-A | Quinoline derivatives as inhibitors of MEK enzymes | ASTRAZENECA AB (SE) | 2002-05-22 | — | — | CN | disclosed |
| CN-1195988-A | Immunosuppressant | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1998-10-14 | — | — | CN | disclosed |
| CN-1181376-A | Production of benzophenone derivatives | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1998-05-13 | — | — | CN | disclosed |
| CN-1156453-A | Process for preparing quinazoline or quinoline derivatives and intermediates therefor | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-08-06 | — | — | CN | disclosed |
| EP-0749426-A1 | QUINOLINE OR QUINAZOLINE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS, IN PARTICULAR FOR TREATING ARTHRITIS | Takeda Chemical Industries, Ltd. (JP) | 1996-12-27 | — | — | EP | disclosed |
| WO-1995024394-A1 | QUINOLINE OR QUINAZOLINE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS, IN PARTICULAR FOR TREATING ARTHRITIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-09-14 | — | — | WO | disclosed |