Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 5/20 | 0.55 |
| ▸ | QDPR | P09417 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11595671 | 0.84 | ACMSD (0.54) | ESR2QDPRCYP3A4HIF1AMEN1 | |
| SCHEMBL28541380 | 0.82 | ACMSD (0.56) | QDPRCYP3A4HIF1AMEN1SLC22A1 | |
| SCHEMBL25255892 | 0.81 | ACMSD (0.39) | ESR2QDPRCYP3A4HIF1AMEN1 | |
| SCHEMBL5882387 | 0.80 | QDPR (0.47) | ESR2QDPRHSP90AA1ACMSDESR1 | |
| SCHEMBL4842148 | 0.78 | MEN1 (0.36) | ESR2QDPRCYP3A4HIF1AMEN1 | |
| SCHEMBL21237804 | 0.77 | ESR2 (0.56) | ESR2QDPRACMSDESR1CA2 | |
| SCHEMBL18403459 | 0.77 | ALOX5 (0.45) | ESR2QDPRCYP3A4ACMSDCYP2C9 | |
| SCHEMBL14144425 | 0.76 | ESR2 (0.41) | ESR2QDPRACMSD | |
| SCHEMBL27596781 | 0.76 | HSPA5 (0.50) | QDPRCYP3A4HIF1AMEN1SLC22A1 | |
| SCHEMBL2721166 | 0.75 | ESR2 (0.53) | ESR2CYP3A4CYP2C9ESR1 |
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-6767949-B1 | REDUCING AGENT COMPRISING PHOSPHORUS COMPOUND, SULFUR COMPOUND OR ETHYLENICALLY UNSATURATED CYCLIC COMPOUND; DISCOLORATION INHIBITION | CIBA SPECIALTY CHEMICALS CORPORATION | 2004-07-27 | — | — | US | disclosed |