Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | LITAF | Q99732 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 4/20 | 0.42 |
| ▸ | EDNRB | P24530 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7842798 | 0.90 | MAPK8 (0.46) | MEN1KMT2AMAPK1MAPK8MAPT | |
| SCHEMBL7841358 | 0.79 | GNRHR (0.46) | CYP1A2CYP2C9CYP2C19MEN1KMT2A | |
| SCHEMBL7852099 | 0.76 | GNRHR (0.52) | MEN1KMT2AMAPK1LMNAMAPT | |
| SCHEMBL7842945 | 0.76 | GNRHR (0.51) | — | |
| SCHEMBL7852573 | 0.75 | MEN1 (0.41) | MEN1KMT2AMAPK1LMNATNF | |
| SCHEMBL7851919 | 0.75 | MAPT (0.43) | CYP1A2CYP2C9MEN1KMT2AMAPK1 | |
| SCHEMBL7851615 | 0.75 | MAPT (0.43) | MEN1KMT2AMAPK1MAPTPOLB | |
| SCHEMBL7857100 | 0.75 | GNRHR (0.55) | MEN1KMT2AMAPK1MAPTPOLB | |
| SCHEMBL7852445 | 0.74 | CYP1A2 (0.52) | CYP1A2CYP2C9CYP2C19MEN1KMT2A | |
| SCHEMBL7850711 | 0.72 | GNRHR (0.50) | AGTR1EDNRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640606-B1 | Thienopyrimidine derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-11-07 | — | — | EP | disclosed |
| US-6140325-A | HAS ENDOTHELIN ANTAGONISTIC ACTION; FOR TREATING LIVER HYPOFUNCTION, ACUTE RENAL INSUFFICIENCY, CARDIAC INFARCTION OR LIVER INSUFFICIENCY, VASOCONSTRICTION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-10-31 | — | — | US | disclosed |
| EP-0640606-A1 | Thienopyrimidine derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-03-01 | — | — | EP | disclosed |