Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | F10 | P00742 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4443579 | 0.85 | POLB (0.53) | POLBTDP1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1856429 | 0.77 | POLB (0.51) | POLBTDP1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1857400 | 0.74 | POLB (0.49) | POLBTDP1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1859707 | 0.72 | POLB (0.53) | POLBTDP1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1856417 | 0.71 | MMP2 (0.54) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1857442 | 0.70 | CPA3 (0.49) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20642242 | 0.68 | ALDH1A1 (0.46) | TDP1MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL31689561 | 0.67 | SLC7A5 (0.59) | TDP1KDM4E | |
| SCHEMBL20032309 | 0.66 | TNNI3K (0.45) | TDP1KMT2ASMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL8039484 | 0.66 | HTR6 (0.58) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009080722-A2 | CARBOXYLIC DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2009-07-02 | — | — | WO | disclosed |