Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HB | P07237 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | TRPV3 | Q8NET8 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17991533 | 1.00 | P4HB (0.45) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL29501152 | 1.00 | P4HB (0.45) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL29990765 | 1.00 | P4HB (0.45) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL29501148 | 1.00 | P4HB (0.45) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL17973668 | 1.00 | P4HB (0.45) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL17960306 | 0.90 | TDP1 (0.40) | P4HBALDH1A1TDP1KDM4ETRPV3 | |
| SCHEMBL17958078 | 0.90 | TDP1 (0.40) | P4HBALDH1A1TDP1KDM4ETRPV3 | |
| SCHEMBL17958077 | 0.90 | TDP1 (0.40) | P4HBALDH1A1TDP1KDM4ETRPV3 | |
| SCHEMBL17973666 | 0.89 | TDP1 (0.46) | P4HBNOTUMCCR6HKDC1ALDH1A1 | |
| SCHEMBL28601921 | 0.89 | TDP1 (0.46) | P4HBNOTUMCCR6HKDC1ALDH1A1 |
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-107873023-B | 3-alkyl-4-amido-bicyclo [4, 5, 0] hydroxamic acids as HDAC inhibitors | 福马治疗股份有限公司 | 2021-07-23 | — | — | CN | disclosed |