Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | NT5E | P21589 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5515850 | 0.85 | ALDH1A1 (0.52) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL5519278 | 0.81 | TAS1R3 (0.54) | MAOBALDH1A1KDM4ECYP1A2MAOA | |
| SCHEMBL11346189 | 0.81 | ALOX5 (0.57) | MAOBALDH1A1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL11349135 | 0.79 | MAOB (0.46) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL10368234 | 0.76 | FLT3 (0.52) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL14471296 | 0.75 | ALDH1A1 (0.55) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL14587017 | 0.74 | CYP2D6 (0.54) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL11354104 | 0.74 | LMNA (0.55) | ALDH1A1KDM4ECA12CA9LMNA | |
| SCHEMBL12626506 | 0.73 | CYP2D6 (0.49) | FLT3MAOBALDH1A1KDM4ECYP1A2 | |
| SCHEMBL12569555 | 0.73 | CYP2D6 (0.49) | FLT3MAOBALDH1A1KDM4ECYP1A2 |
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-0020391-A1 | SUBSTITUTED ACETIC ACID ESTERS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1981-01-07 | — | — | EP | disclosed |
| WO-1980000563-A1 | SUBSTITUTED ACETIC ACID ESTERS | SOREX LTD (GB) | 1980-04-03 | — | — | WO | disclosed |