Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8321990 | 0.80 | ACP3 (0.47) | MAPTALOX12HTTTAAR1OPRM1 | |
| SCHEMBL94275 | 0.80 | HTR2A (0.52) | TDP1TAAR1HTR2AHRH1LMNA | |
| Benzene SCHEMBL7084450 | 0.80 | HDAC4 (0.54) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| Hydrochloric Acid SCHEMBL14157128 | 0.78 | TAAR1 (0.61) | KIF11TAAR1HTR2AHRH1SLC6A2 | |
| Hydrogen Peroxide SCHEMBL315899 | 0.78 | HDAC4 (0.58) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| Hydrogen Peroxide SCHEMBL1877668 | 0.78 | HDAC4 (0.58) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| Hydrogen Peroxide SCHEMBL28407249 | 0.78 | HDAC4 (0.58) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| Ethylene SCHEMBL27975151 | 0.78 | HDAC4 (0.52) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| SCHEMBL374780 | 0.78 | HDAC4 (0.56) | KIF11HDAC4HDAC8TDP1CYP3A4 | |
| SCHEMBL8325499 | 0.76 | IDO1 (0.49) | HDAC4SLC6A2SLC6A4OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |