Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | ELANE | P08246 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | CYP26A1 | O43174 | 7/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL7598842 | 0.85 | ESR1 (0.45) | ESR1ESR2ELANECA12CA1 | |
| SCHEMBL4278598 | 0.84 | ADRB2 (0.40) | ELANECYP26A1CYP2C9ADRB2ADRB1 | |
| SCHEMBL10905859 | 0.83 | KCNN4 (0.50) | CYP26A1CYP2C9ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL4285619 | 0.78 | ALDH1A1 (0.62) | CYP26A1ALDH1A1SMN1; SMN2KDM4EADRB2 | |
| SCHEMBL13448250 | 0.76 | CYP26A1 (0.37) | CYP26A1 | |
| SCHEMBL13304117 | 0.75 | BLM (0.39) | CYP26A1BLMNPSR1 | |
| SCHEMBL11481283 | 0.74 | SMN1; SMN2 (0.56) | ALDH1A1BLMSMN1; SMN2KDM4EHIF1A | |
| SCHEMBL2452815 | 0.73 | ESR1 (0.50) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL4280477 | 0.73 | GABBR2 (0.49) | CYP26A1CYP2C9SMN1; SMN2NPSR1CYP1A2 | |
| SCHEMBL384968 | 0.72 | ESR1 (0.58) | ESR1ESR2CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009153566-A1 | CYP26 INHIBITORS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2009-12-23 | — | — | WO | disclosed |
| WO-2009153566-A1 | CYP26 INHIBITORS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2009-12-23 | — | — | WO | disclosed |