Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 4/20 | 0.41 |
| ▸ | CES1 | P23141 | 4/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10585786 | 0.80 | ALDH1A1 (0.41) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL451258 | 0.79 | ATM (0.54) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL1254294 | 0.73 | ATM (0.48) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL11647086 | 0.72 | SMN1; SMN2 (0.44) | CYP19A1CES2CES1MCL1ALDH1A1 | |
| SCHEMBL814927 | 0.71 | CES2 (0.52) | CYP19A1ATMCES2CES1ESR1 | |
| SCHEMBL3240424 | 0.71 | ATM (0.46) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL8582690 | 0.71 | ATM (0.46) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL136826 | 0.70 | CES1 (0.56) | CYP19A1CES2CES1MCL1ALDH1A1 | |
| SCHEMBL628981 | 0.70 | ATM (0.45) | CYP19A1ATMCES2CES1ALDH1A1 | |
| SCHEMBL22313390 | 0.70 | CES1 (0.56) | CYP19A1CES2CES1MCL1ALDH1A1 |
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-2352736-A1 | METHOD FOR PRODUCING MONO-AMINOFUNCTIONALIZED DIALKYLPHOSPHINIC ACIDS AND ESTERS AND SALTS THEREOF AND USE THEREOF | Clariant International Ltd. (CH) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010051886-A1 | METHOD FOR PRODUCING MONO-AMINOFUNCTIONALIZED DIALKYLPHOSPHINIC ACIDS AND ESTERS AND SALTS THEREOF AND USE THEREOF | CLARIANT INTERNATIONAL LTD (CH) | 2010-05-14 | — | — | WO | disclosed |