Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28588234 | 0.81 | RAB9A (0.50) | LMNACYP1A2CYP3A4TSHRCYP2C9 | |
| SCHEMBL30180494 | 0.81 | RAB9A (0.50) | LMNACYP1A2CYP3A4TSHRCYP2C9 | |
| SCHEMBL6434747 | 0.77 | CCNT1 (0.41) | HCAR3ALDH1A1KDM4EPPIBPPIA | |
| SCHEMBL13685154 | 0.75 | PTGS1 (0.43) | HCAR3 | |
| SCHEMBL28120960 | 0.74 | ALOX12 (0.51) | LMNACYP3A4TSHRALDH1A1HPGD | |
| SCHEMBL28042930 | 0.73 | TSHR (0.60) | LMNACYP1A2CYP3A4TSHRCYP2C9 | |
| SCHEMBL6946116 | 0.72 | RAB9A (0.58) | LMNATSHRALDH1A1NPC1RAB9A | |
| SCHEMBL11707466 | 0.71 | HCAR3 (0.57) | LMNAHCAR3ALDH1A1RAB9AHPGD | |
| SCHEMBL2556214 | 0.70 | ALDH1A1 (0.44) | LMNACYP1A2TSHRALDH1A1HPGD | |
| SCHEMBL2911978 | 0.70 | HCAR3 (0.56) | LMNAHCAR3ALDH1A1HPGDHRH4 |
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-1047425-A4 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 2009-04-22 | — | — | EP | disclosed |
| EP-1047425-A1 | INTEGRIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999030709-A1 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1999-06-24 | — | — | WO | disclosed |