Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | DHFR | P00374 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.46 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10235885 | 0.84 | KMT2A (0.54) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL1047449 | 0.83 | TAAR1 (0.64) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL18427030 | 0.83 | LMNA (0.53) | KMT2ADHFRCYP2D6SMN1; SMN2KCNH2 | |
| SCHEMBL8046926 | 0.83 | KMT2A (0.57) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL9166584 | 0.83 | DHFR (0.51) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL3811700 | 0.83 | CYP4F2 (0.63) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL7853630 | 0.83 | KMT2A (0.49) | KMT2ADHFRCA1CA2CA7 | |
| SCHEMBL59488 | 0.82 | KDM4E (0.61) | KMT2ADHFRKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10236068 | 0.81 | PPARA (0.67) | CYP2D6PPARGPPARAKCNH2GGPS1 | |
| SCHEMBL8957636 | 0.81 | PPARA (0.67) | CYP2D6PPARGPPARAKCNH2GGPS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5420128-A | Pyrimidine derivatives, method of manufacturing the same, and androgen inhibitor | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-05-30 | — | — | US | disclosed |
| EP-0503099-A1 | PYRIMIDINE DERIVATIVE, PRODUCTION THEREOF, AND ANDROGEN INHIBITOR | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-09-16 | — | — | EP | disclosed |