Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR2A | P27037 | 6/20 | 0.43 |
| ▸ | TGFBR2 | P37173 | 6/20 | 0.43 |
| ▸ | LOX | P28300 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.41 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL16116782 | 0.84 | LOX (0.55) | ACVR2ATGFBR2LOXLOXL2GABRA1 | |
| SCHEMBL30626327 | 0.84 | LOX (0.55) | ACVR2ATGFBR2LOXLOXL2GABRA1 | |
| SCHEMBL10220722 | 0.83 | CYP2A6 (0.50) | LOXL2CYP19A1 | |
| SCHEMBL13036116 | 0.79 | DYRK1A (0.55) | ACVR2ATGFBR2LOXLOXL2AAK1 | |
| SCHEMBL14063615 | 0.77 | KIF11 (0.53) | AAK1DYRK1AS1PR1 | |
| SCHEMBL29141734 | 0.77 | DYRK1A (0.53) | ACVR2ATGFBR2LOXLOXL2AAK1 | |
| SCHEMBL15889315 | 0.77 | S1PR1 (0.47) | ACVR2ATGFBR2LOXLOXL2AAK1 | |
| SCHEMBL16404625 | 0.76 | CNR1 (0.49) | ACVR2ATGFBR2LOXLOXL2LRRK2 | |
| SCHEMBL10220737 | 0.76 | SYK (0.53) | — | |
| SCHEMBL18481804 | 0.76 | LOX (0.47) | ACVR2ATGFBR2LOXLOXL2AAK1 |
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-7429604-B2 | Six-membered heterocycles useful as serine protease inhibitors | BRISTOL MYERS SQUIBB COMPANY (US) | 2008-09-30 | — | — | US | disclosed |