Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11211110 | 0.77 | HSD17B10 (0.45) | CYP1A2CYP2C19ALDH1A1MAPTMTNR1A | |
| SCHEMBL11206968 | 0.76 | MTNR1B (0.56) | MTNR1AMTNR1B | |
| SCHEMBL11208904 | 0.72 | CYP2C9 (0.40) | CYP1A2CYP3A4CYP2C9NPC1ALDH1A1 | |
| SCHEMBL8995832 | 0.71 | HSD17B2 (0.41) | HSD17B1DHODHHSD17B2MAPTHDAC2 | |
| SCHEMBL11434471 | 0.70 | TDP1 (0.45) | CYP1A2CYP3A4NPC1ALDH1A1MAPT | |
| SCHEMBL11222538 | 0.70 | DHODH (0.44) | DHODHFFAR1 | |
| SCHEMBL30196125 | 0.70 | CA12 (0.59) | ERN1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL22651658 | 0.70 | CA12 (0.59) | ERN1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Acetic Acid SCHEMBL28960935 | 0.70 | HDAC4 (0.61) | HSD17B2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9278319 | 0.68 | HSD17B2 (0.43) | HSD17B1ERN1HSD17B2CYP1A2CYP3A4 |
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-4331443-A | Concentrated solutions of water-insoluble coupling components | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| US-4221709-A | Azo pigments | DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) | 1980-09-09 | — | — | US | disclosed |