Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | GAA | P10253 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6405225 | 0.95 | HSD17B10 (0.78) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| Acetic Acid SCHEMBL28256456 | 0.90 | HSD17B10 (0.66) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL25528714 | 0.84 | HSD17B10 (0.72) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL29357214 | 0.83 | HSD17B10 (1.00) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL36762 | 0.83 | HSD17B10 (1.00) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL12305654 | 0.79 | HSD17B10 (0.69) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL27937771 | 0.77 | HSD17B10 (0.49) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL27657488 | 0.77 | IDH1 (0.58) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL10598309 | 0.77 | CYP1A2 (0.50) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL29417917 | 0.77 | CYP1A2 (0.50) | HSD17B10CYP1A2CYP2C9CYP2C19KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1246790-B1 | SUBSTITUTED 1 AND 2 NAPHTHOL MANNICH BASES | GRUENENTHAL GMBH (DE) | 2005-05-04 | — | — | EP | claimed |
| EP-1246790-B1 | SUBSTITUTED 1 AND 2 NAPHTHOL MANNICH BASES | GRUENENTHAL GMBH (DE) | 2005-05-04 | — | — | EP | disclosed |