Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL7196359 | 0.70 | CYP3A4 (0.42) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL2167134 | 0.69 | CYP3A4 (0.41) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL23687221 | 0.69 | ALDH1A1 (0.34) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL18101499 | 0.68 | CYP3A4 (0.38) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL16315457 | 0.68 | CYP19A1 (0.34) | CYP19A1ALOX5 | |
| SCHEMBL14498565 | 0.68 | ALDH1A1 (0.33) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL18101500 | 0.67 | ALDH1A1 (0.35) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL18101498 | 0.67 | ALDH1A1 (0.33) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL3784428 | 0.66 | CYP3A4 (0.39) | CYP3A4TSHRTP53ALDH1A1GAA | |
| SCHEMBL7175708 | 0.65 | CYP3A4 (0.38) | CYP3A4TSHRTP53ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5624950-A | USEFUL IN TREATMENT OF ANALGESIA, INFLAMMATION, ASTHMA, ALLERGIES, CENTRAL NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS, IMMUNE SYSTEM DISORDERS, ANTISPASMODIC AGENTS, ANTIEMETIC AGENTS | RHONE-POULENC RORER S.A. (FR) | 1997-04-29 | — | — | US | disclosed |