Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| SCHEMBL8370158 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TSHRHPGDKMT2A | |
| SCHEMBL164037 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TSHRHPGDKMT2A | |
| SCHEMBL30474848 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TSHRHPGDKMT2A | |
| SCHEMBL22854153 | 0.81 | MEN1 (0.52) | CYP3A4HPGDKMT2AMEN1CYP1A2 | |
| SCHEMBL11816940 | 0.76 | KMT2A (0.52) | ALDH1A1CYP3A4HPGDKMT2AMEN1 | |
| SCHEMBL1276632 | 0.76 | MAOB (0.66) | ALDH1A1CYP3A4TSHRHPGDKMT2A | |
| SCHEMBL11813894 | 0.75 | KMT2A (0.51) | ALDH1A1CYP3A4HPGDKMT2AMEN1 | |
| SCHEMBL8850870 | 0.75 | CYP3A4 (0.63) | ALDH1A1CYP3A4TSHRHPGDKDM4E | |
| SCHEMBL2618697 | 0.75 | CYP2D6 (0.53) | CYP3A4KMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL6014667 | 0.75 | MEN1 (0.53) | ALDH1A1CYP3A4KMT2AMEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5336670-A | 2,2-dimethyl-3-(but-1-en-3-ynyl)-cyclopropane carboxylates | ROUSSEL-UCLAF (FR) | 1994-08-09 | — | — | US | disclosed |
| EP-0093664-A1 | Ester of cyclopropanecarboxylic acid and (S)-cyano-(4-fluoro-3-phenoxyphenyl)-methyl alcohol, its preparation, its use in combating parasites and compositions containing it | ROUSSEL-UCLAF (FR) | 1983-11-09 | — | — | EP | disclosed |