Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6872347 | 0.83 | ESR1 (0.44) | KDM4EALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL6883532 | 0.82 | OPRM1 (0.41) | KDM4EOPRM1OPRD1OPRK1ESR1 | |
| Hydrochloric Acid SCHEMBL4458289 | 0.82 | ESR1 (0.43) | MAPTOPRM1ESR1APPESR2 | |
| SCHEMBL9773235 | 0.80 | MAPT (0.48) | KDM4EALDH1A1MAPTKMT2ATAAR1 | |
| SCHEMBL8601821 | 0.80 | MAPT (0.48) | KDM4EALDH1A1MAPTKMT2A | |
| SCHEMBL9773231 | 0.79 | KDM4E (0.46) | KDM4EALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL27056901 | 0.78 | KDM4E (0.47) | KDM4EALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL6884063 | 0.77 | ESRRG (0.47) | KDM4EALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL6880339 | 0.77 | ESR1 (0.42) | KDM4EALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL16416312 | 0.77 | APP (0.42) | KDM4EALDH1A1MAPTKMT2AESR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0853079-B1 | Production of keto acids | CIBA SC HOLDING AG (CH) | 2002-06-05 | — | — | EP | disclosed |
| US-5925787-A | Production of keto acids | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1999-07-20 | — | — | US | disclosed |
| EP-0853079-A1 | Production of keto acids | Ciba SC Holding AG (CH) | 1998-07-15 | — | — | EP | disclosed |