Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.56 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 7/20 | 0.43 |
| ▸ | CA2 | P00918 | 7/20 | 0.43 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | MPO | P05164 | 2/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6525138 | 0.85 | PKM (0.41) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL3863425 | 0.79 | AKR1B1 (0.59) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL7735450 | 0.79 | AKR1B1 (0.58) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL251843 | 0.77 | AKR1B1 (0.56) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL10433512 | 0.77 | AKR1B1 (0.56) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL10831200 | 0.77 | FDPS (0.40) | AKR1B1TAAR1TSHRKDM4EALDH1A1 | |
| SCHEMBL4655209 | 0.77 | AKR1B1 (0.68) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL299227 | 0.77 | AKR1B1 (0.68) | AKR1B1HSPA5TAAR1IDO1TSHR | |
| SCHEMBL8033737 | 0.76 | PKM (0.35) | AKR1B1HSPA5TAAR1TSHRHSD17B10 | |
| Methane SCHEMBL22289679 | 0.76 | AKR1B1 (0.65) | AKR1B1HSPA5TAAR1IDO1TSHR |
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-4843160-A | Preparation of alpha-aminoalkylphenols | THE DOW CHEMICAL COMPANY (US) | 1989-06-27 | — | — | US | disclosed |