Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 9/20 | 0.50 |
| ▸ | MAOA | P21397 | 9/20 | 0.50 |
| ▸ | MAOB | P27338 | 9/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10507213 | 0.86 | MAPT (0.50) | KDM1AMAOAMAOBCYP3A4CYP2C19 | |
| SCHEMBL3288161 | 0.82 | ALDH1A1 (0.48) | MAOBCYP3A4CYP2C19CYP2D6MAPT | |
| SCHEMBL10750020 | 0.80 | LIG1 (0.46) | KDM1AMAPTGAAKMT2A | |
| SCHEMBL28427733 | 0.80 | CYP3A4 (0.33) | KDM1AMAOAMAOBCYP3A4CYP2C19 | |
| SCHEMBL10746143 | 0.80 | CYP2C19 (0.49) | KDM1ACYP2C19GAA | |
| SCHEMBL2796226 | 0.78 | KDM1A (0.48) | KDM1AMAPTTSHRKMT2A | |
| SCHEMBL6320806 | 0.77 | MAPT (0.51) | KDM1AMAOAMAOBCYP3A4MAPT | |
| SCHEMBL25025889 | 0.76 | CYP3A4 (0.52) | KDM1AMAOAMAOBCYP3A4CYP2D6 | |
| SCHEMBL20503288 | 0.75 | KDM1A (0.41) | KDM1AMAOAMAOBCYP3A4CYP2C19 | |
| SCHEMBL3947348 | 0.72 | KDM1A (0.47) | KDM1AMAOAMAOBCYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4681952-A | Intermediates in the preparation of 2,2-dimethyl-3-aryl-cyclopropanecarboxylic acids and esters | BAYER AKTIENGESELLSCHAFT (DE) | 1987-07-21 | — | — | US | disclosed |