Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17505192 | 0.80 | BRPF1 (0.56) | ALDH1A1TSHRGAASMN1; SMN2CYP3A4 | |
| SCHEMBL140196 | 0.80 | ALDH1A1 (0.42) | ALDH1A1TSHRGAALMNACYP3A4 | |
| SCHEMBL28325704 | 0.78 | PLA2G10 (0.50) | ALDH1A1TSHRSMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL29941621 | 0.78 | CA12 (0.53) | ALDH1A1TSHRGAAHPGDHTT | |
| SCHEMBL3046549 | 0.78 | CA12 (0.53) | ALDH1A1TSHRGAAHPGDHTT | |
| SCHEMBL28409273 | 0.77 | CA12 (0.52) | ALDH1A1TSHRGAAHPGDHTT | |
| SCHEMBL28412720 | 0.77 | CA12 (0.52) | ALDH1A1TSHRGAAHPGDHTT | |
| SCHEMBL9156616 | 0.76 | POLB (0.51) | ALDH1A1HPGDHTTLMNASMN1; SMN2 | |
| SCHEMBL21074449 | 0.76 | ASIC3 (0.42) | ALDH1A1TSHRGAALMNACYP3A4 | |
| SCHEMBL17505181 | 0.75 | ALDH1A1 (0.52) | ALDH1A1HPGDHTTLMNASMN1; SMN2 |
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-5410054-A | Heteroaryl quinolines as inhibitors of leukotriene biosynthesis | MERCK FROSST CANADA, INC. (CA) | 1995-04-25 | — | — | US | disclosed |