Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 2/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9573261 | 0.84 | GAA (0.39) | RENCCR6PAX8KCNH2TSHR | |
| SCHEMBL6949217 | 0.78 | TAAR1 (0.42) | TSHRNPC1RAB9ABCHE | |
| SCHEMBL8960248 | 0.77 | TSHR (0.41) | TSHRALDH1A1CCNB2CDK1CDK4 | |
| SCHEMBL6951407 | 0.77 | HTT (0.44) | CCR6PAX8NPC1ALDH1A1RAB9A | |
| SCHEMBL1415899 | 0.76 | TSHR (0.38) | TSHRKDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL10473639 | 0.76 | CARM1 (0.41) | TSHRALDH1A1CYP2C9CYP2C19CCNB2 | |
| SCHEMBL8495462 | 0.76 | CCR6 (0.38) | CCR6PAX8TSHRALDH1A1CYP2C9 | |
| SCHEMBL7372303 | 0.76 | TSHR (0.42) | TSHRCYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9417052 | 0.76 | TSHR (0.38) | CCR6PAX8TSHRALDH1A1CYP3A4 | |
| SCHEMBL26130465 | 0.76 | ALOX5 (0.40) | TSHRALDH1A1BCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140203-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | Du Pont Pharmaceuticals Company (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000035488-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | DU PONT PHARMACEUTICALS COMPANY (US) | 2000-06-22 | — | — | WO | disclosed |