Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HBB | P68871 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL4723251 | 0.75 | HRH3 (0.39) | ALDH1A1CASP1CASP7HSD17B10TDP1 | |
| SCHEMBL4723274 | 0.74 | HRH3 (0.38) | ALDH1A1CASP1CASP7HSD17B10TDP1 | |
| SCHEMBL4721897 | 0.71 | HTR3A (0.53) | ALDH1A1CYP3A4HSD17B10TDP1KDM4E | |
| SCHEMBL4722138 | 0.71 | LMNA (0.41) | ALDH1A1TDP1KDM4ENPC1POLB | |
| SCHEMBL4723137 | 0.71 | PRKDC (0.39) | RAB9A | |
| SCHEMBL4765515 | 0.70 | — | — | |
| SCHEMBL15366386 | 0.70 | ALDH1A1 (0.40) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| SCHEMBL4721597 | 0.69 | HTR3A (0.46) | ALDH1A1CYP3A4HSD17B10TDP1KDM4E | |
| SCHEMBL195377 | 0.69 | ALDH1A1 (0.36) | ALDH1A1CYP3A4ALOX15CASP1CASP7 | |
| SCHEMBL1128294 | 0.68 | CYP1A2 (0.43) | ALDH1A1CYP3A4ALOX15CASP1CASP7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6284925-B1 | HYDROGENATION CATALYSTS FOR HYDROGENATION OF DOUBLE BONDS OR IMINE GROUPS | DEGUSSA-HULS AG (DE) | 2001-09-04 | — | — | US | claimed |
| US-6284925-B1 | HYDROGENATION CATALYSTS FOR HYDROGENATION OF DOUBLE BONDS OR IMINE GROUPS | DEGUSSA-HULS AG (DE) | 2001-09-04 | — | — | US | disclosed |