Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.44 |
| ▸ | BCR | P11274 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4632612 | 0.92 | ADORA2A (0.41) | ABL1BCRADORA2AADORA3ADORA1 | |
| SCHEMBL741094 | 0.90 | ABL1 (0.48) | ABL1BCRAURKAADORA2AADORA3 | |
| SCHEMBL1433977 | 0.87 | ABL1 (0.41) | ABL1BCRAURKAKDM4ELMNA | |
| SCHEMBL1433978 | 0.87 | ABL1 (0.46) | ABL1BCRAURKAADORA2AADORA3 | |
| SCHEMBL739466 | 0.87 | AURKA (0.51) | ABL1BCRAURKAKDM4ELMNA | |
| SCHEMBL1434063 | 0.86 | ABL1 (0.63) | ABL1BCRAURKAKDM4ELMNA | |
| SCHEMBL742843 | 0.86 | LMNA (0.47) | ADORA2AADORA3ADORA1BRAFKDM4E | |
| SCHEMBL738735 | 0.86 | KDM4E (0.43) | KDM4ELMNAKMT2AMAPTTP53 | |
| SCHEMBL739785 | 0.85 | ABL1 (0.57) | ABL1BCRAURKAKDM4EMAPT | |
| SCHEMBL1780180 | 0.85 | KDM4E (0.38) | ABL1BCRAURKAKDM4EKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1711177-B1 | 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS | PFIZER ITALIA SRL (IT) | 2008-05-28 | — | — | EP | disclosed |