Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 5/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | AR | P10275 | 2/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.43 |
| ▸ | CASP6 | P55212 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL29475630 | 0.85 | CTSB (0.59) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL2778988 | 0.85 | CTSB (0.59) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL26656853 | 0.84 | CTSB (0.58) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL13110624 | 0.84 | CTSB (0.58) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL6815898 | 0.84 | CTSB (0.58) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL4440398 | 0.82 | CTSB (0.56) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL7788656 | 0.82 | TDP1 (0.80) | CTSBTDP1ALDH1A1ARCASP6 | |
| SCHEMBL8728039 | 0.81 | CTSB (0.54) | CTSBTDP1ALDH1A1ARAKR1C4 | |
| SCHEMBL5789105 | 0.80 | AKR1C4 (0.55) | CTSBTDP1ALDH1A1AKR1C4AKR1C3 | |
| SCHEMBL436389 | 0.76 | ALDH1A1 (0.66) | TDP1ALDH1A1KDM4EMAPTHTT |
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-5155113-A | Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-10-13 | — | — | US | disclosed |
| EP-0180188-A2 | A composition for increasing the anti-cancer activity of an anti-cancer compound | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1986-05-07 | — | — | EP | disclosed |