Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCND1 | P24385 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ME2 | P23368 | 1/20 | 0.40 |
| ▸ | ME1 | P48163 | 1/20 | 0.40 |
| ▸ | ME3 | Q16798 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8604971 | 0.78 | MTNR1A (0.46) | EGFRCDK4CCND1CYP3A4ALDH1A1 | |
| SCHEMBL8604085 | 0.72 | CNR1 (0.39) | EGFRCDK4CCND1ALDH1A1ME2 | |
| SCHEMBL7256852 | 0.72 | ALDH1A1 (0.56) | EGFRCDK4CCND1ABCG2CYP3A4 | |
| SCHEMBL20704965 | 0.71 | ALDH1A1 (0.48) | ABCG2ALDH1A1CYP1A2SMN1; SMN2KDM4E | |
| SCHEMBL7262295 | 0.71 | ALDH1A1 (0.57) | EGFRABCG2CYP3A4ALDH1A1SMN1; SMN2 | |
| SCHEMBL24825685 | 0.71 | ALDH1A1 (0.42) | EGFRABCG2ALDH1A1PDE3BPDE3A | |
| SCHEMBL1933389 | 0.70 | EGFR (0.47) | EGFRABCG2CYP3A4ALDH1A1KDM4E | |
| SCHEMBL6096141 | 0.68 | HTR2A (0.44) | EGFRCDK4CCND1ABCG2ALDH1A1 | |
| SCHEMBL27942149 | 0.68 | TUBB1 (0.46) | ABCG2ALDH1A1USP2SMN1; SMN2ERN1 | |
| SCHEMBL4500573 | 0.67 | ABCG2 (0.49) | ABCG2CYP3A4ALDH1A1CYP1A2PDE3B |
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 |
|---|---|---|---|---|---|---|---|
| US-5780496-A | Method and compositions for inhibition of adaptor protein/tyrosine kinase interactions | SUGEN, INC. (US) | 1998-07-14 | — | — | US | claimed |
| US-5786488-A | DEHYDROBROMINATION OF A DIBROMOBENZOQUINONES WITH AT LEAST ONE INDOLES IN A POLAR SOLVENT AND A METAL CARBONATE TO FORM AN ANTITUMOR AGENT | SUGEN, INC. (US) | 1998-07-28 | — | — | US | disclosed |
| US-5780496-A | Method and compositions for inhibition of adaptor protein/tyrosine kinase interactions | SUGEN, INC. (US) | 1998-07-14 | — | — | US | disclosed |