Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | BUB1 | O43683 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 5/20 | 0.37 |
| ▸ | ACACA | Q13085 | 5/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13817837 | 0.83 | BUB1 (0.36) | HTTBUB1HPGDGFERHSD17B10 | |
| SCHEMBL13817849 | 0.81 | ACACB (0.47) | HTTBUB1HPGDACACBACACA | |
| SCHEMBL2355632 | 0.80 | ACACB (0.59) | HTTBUB1HPGDGFERHSD17B10 | |
| SCHEMBL13817791 | 0.74 | HTT (0.38) | HTTBUB1HPGDHSD17B10ACACB | |
| SCHEMBL2351711 | 0.74 | ACACB (0.50) | ACACBACACATGM2CES1BIRC5 | |
| SCHEMBL2354577 | 0.73 | ACACB (0.49) | ACACBACACATGM2CES1BIRC5 | |
| SCHEMBL12479210 | 0.72 | ACACB (0.51) | ACACBACACATGM2CES1BIRC5 | |
| SCHEMBL13817835 | 0.71 | HTT (0.43) | HTTBUB1HPGDGFERHSD17B10 | |
| SCHEMBL14689611 | 0.71 | ACACB (0.53) | ACACBACACATGM2CES1BIRC5 | |
| SCHEMBL14689609 | 0.71 | ACACB (0.53) | ACACBACACATGM2CES1BIRC5 |
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-7547660-B2 | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AKTIENGESELLSCHAFT (DE) | 2009-06-16 | — | — | US | disclosed |
| US-7547660-B2 | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AKTIENGESELLSCHAFT (DE) | 2009-06-16 | — | — | US | disclosed |