Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29065807 | 1.00 | ALOX5 (0.45) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL28814772 | 1.00 | ALOX5 (0.45) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL2871139 | 0.85 | CES2 (0.44) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL2871143 | 0.85 | CES2 (0.44) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL97784 | 0.85 | CES2 (0.44) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL1520244 | 0.83 | ALOX5 (0.43) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL1143873 | 0.83 | ALOX5 (0.43) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL7279728 | 0.81 | KCNA5 (0.44) | RAB9AALDH1A1HPGDNPC1KMT2A | |
| SCHEMBL6408559 | 0.81 | ALOX5 (0.41) | ALOX5RAB9AALDH1A1HPGDNPC1 | |
| SCHEMBL4364840 | 0.80 | ALDH1A1 (0.49) | ALOX5RAB9AALDH1A1HPGDNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114891838-B | Synthesis method of dorzolamide hydrochloride intermediate (S) -3- (2-thiophenyl) -butyric acid | 株洲壹诺生物技术有限公司 | 2023-09-08 | — | — | CN | disclosed |