Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13817835 | 0.86 | HTT (0.43) | BUB1HTTALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL13817830 | 0.83 | HTT (0.42) | BUB1HTTTDP2ALDH1A1SMN1; SMN2 | |
| SCHEMBL13817838 | 0.78 | NCEH1 (0.38) | TDP2ALDH1A1SMN1; SMN2CYP1A2KDM4E | |
| SCHEMBL13817791 | 0.78 | HTT (0.38) | BUB1HTTALDH1A1HPGDKDM4E | |
| SCHEMBL13817808 | 0.76 | BUB1 (0.32) | BUB1HTT | |
| SCHEMBL13817822 | 0.75 | ALDH1A1 (0.40) | BUB1HTTALDH1A1HPGDKDM4E | |
| SCHEMBL30512977 | 0.71 | HTT (0.58) | HTTTDP2ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL2355632 | 0.71 | ACACB (0.59) | BUB1HTTTDP2HPGDGFER | |
| SCHEMBL13817801 | 0.70 | HTT (0.40) | BUB1HTTALDH1A1HPGDKDM4E | |
| SCHEMBL14001512 | 0.68 | GSK3B (0.44) | HTTALDH1A1SMN1; SMN2HPGDCYP1A2 |
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 |