Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15658983 | 0.69 | POLB (0.56) | ALDH1A1NPC1RAB9AMAPTCYP2C19 | |
| SCHEMBL8094050 | 0.69 | POLB (0.76) | ALDH1A1MAPTCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL8087428 | 0.69 | POLB (0.76) | ALDH1A1MAPTCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL44366 | 0.69 | POLB (0.76) | ALDH1A1MAPTCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL4833712 | 0.69 | ALDH1A1 (0.60) | ALDH1A1NPC1RAB9AMAPTCYP2C19 | |
| SCHEMBL8893112 | 0.68 | KMT2A (0.52) | ALDH1A1RAB9APOLBCA12CA1 | |
| SCHEMBL4833237 | 0.68 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9AMAPTCYP2C19 | |
| SCHEMBL4689723 | 0.67 | CA1 (0.63) | ALDH1A1MAPTCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL26005944 | 0.67 | POLB (0.57) | ALDH1A1NPC1RAB9AMAPTCYP2C19 | |
| SCHEMBL4834491 | 0.67 | NOTUM (0.57) | ALDH1A1NPC1RAB9AMAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997024340-A1 | OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-07-10 | — | — | WO | disclosed |