Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | FABP4 | P15090 | 13/20 | 0.45 |
| ▸ | FABP5 | Q01469 | 8/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ASPH | Q12797 | 1/20 | 0.39 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27761964 | 0.85 | KDM4E (0.58) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL15451126 | 0.83 | NPC1 (0.47) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL15268112 | 0.82 | FABP4 (0.46) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL12998745 | 0.82 | TDP1 (0.69) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL2078044 | 0.80 | MAPT (0.45) | KDM4ENPC1POLBMAPTRAB9A | |
| Hydrochloric Acid SCHEMBL17362383 | 0.80 | TDP1 (0.67) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL14544298 | 0.78 | TDP1 (0.65) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL27841279 | 0.78 | PPARA (0.46) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL1655468 | 0.78 | MYC (0.56) | KDM4ENPC1POLBMAPTRAB9A | |
| SCHEMBL20270054 | 0.77 | KDM4E (0.62) | KDM4ENPC1POLBMAPTRAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107954919-A | A kind of preparation method of Rucaparib key intermediates | 南京奇可药业有限公司 | 2018-04-24 | — | — | CN | disclosed |