Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3696286 | 0.81 | CA2 (0.52) | LOXL2CA12CA2CA3CA6 | |
| SCHEMBL3409357 | 0.80 | TAAR1 (0.57) | LOXL2SLC6A2CA12CA2CA3 | |
| SCHEMBL5096892 | 0.79 | LOXL2 (0.37) | LOXL2CA12CA2CA3CA6 | |
| SCHEMBL19329955 | 0.78 | EPHX2 (0.44) | LOXL2CYP19A1KDM4E | |
| SCHEMBL20838414 | 0.78 | EPHX2 (0.44) | LOXL2CYP19A1KDM4E | |
| SCHEMBL25058231 | 0.76 | TAAR1 (0.52) | LOXL2CA12CA2CA9CYP19A1 | |
| SCHEMBL14025087 | 0.74 | LOXL2 (0.38) | LOXL2CA12CA2CA3CA6 | |
| SCHEMBL2296391 | 0.74 | CYP2A6 (0.44) | LOXL2CA12CA2CA3CA6 | |
| SCHEMBL11603519 | 0.74 | TSHR (0.54) | CA12CA2CA3CA6CA9 | |
| SCHEMBL13567549 | 0.73 | CYP2A6 (0.45) | LOXL2CA12CA2CA3CA6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0727425-A1 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1996-08-21 | — | — | EP | disclosed |