Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | XPO1 | O14980 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16795809 | 0.86 | PIN1 (0.42) | ALDH1A1MAPTGAASMN1; SMN2NPSR1 | |
| SCHEMBL10725042 | 0.86 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTSMN1; SMN2KDM4E | |
| SCHEMBL10724757 | 0.82 | GAA (0.38) | GAAKMT2AMEN1 | |
| SCHEMBL10722478 | 0.80 | L3MBTL1 (0.43) | ALDH1A1MAPTGAASMN1; SMN2KDM4E | |
| SCHEMBL11108359 | 0.79 | KDM4E (0.43) | ALDH1A1HPGDMAPTGAAATM | |
| SCHEMBL10723170 | 0.79 | CYP3A4 (0.48) | ALDH1A1HPGDMAPTGAASMN1; SMN2 | |
| SCHEMBL10724853 | 0.78 | ALDH1A1 (0.43) | ALDH1A1MAPTGAAKMT2AMEN1 | |
| SCHEMBL5216184 | 0.77 | NPSR1 (0.49) | ALDH1A1HPGDMAPTGAAATM | |
| SCHEMBL28882448 | 0.77 | PIN1 (0.49) | ALDH1A1MAPTGAASMN1; SMN2NPSR1 | |
| SCHEMBL3966753 | 0.76 | ALDH1A1 (0.48) | ALDH1A1HPGDMAPTGAAATM |
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-0067105-B1 | ALLYL AMINE MAO INHIBITORS | MERRELL DOW FRANCE ET CIE (FR) | 1987-09-23 | — | — | EP | disclosed |
| EP-0067105-A2 | Allyl amine MAO inhibitors | MERRELL DOW FRANCE ET CIE (FR) | 1982-12-15 | — | — | EP | disclosed |