Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORA | P35398 | 1/20 | 0.49 |
| ▸ | RORC | P51449 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6726787 | 0.79 | RAB9A (0.58) | RORARORCROCK2ROCK1BAZ1A | |
| SCHEMBL29865744 | 0.79 | HDAC1 (0.52) | RORARORCROCK2ROCK1BAZ1A | |
| SCHEMBL4982071 | 0.78 | POLB (0.66) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL19074543 | 0.78 | POLB (0.66) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL6717100 | 0.77 | ALDH1A1 (0.63) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL6717109 | 0.77 | ALDH1A1 (0.63) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL5566024 | 0.77 | KMT2A (0.45) | RORARORCROCK2ROCK1BAZ1A | |
| Dimethylamine SCHEMBL6726772 | 0.77 | POLB (0.59) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL23611208 | 0.77 | ROCK2 (0.56) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 | |
| SCHEMBL23611205 | 0.77 | ROCK2 (0.56) | ROCK2ROCK1BAZ1AKMT2ASMN1; SMN2 |
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-7250415-B2 | 1,1-Disubstitutedcycloalkyl-, glycinamidyl-, sulfonyl-amidino-, and tetrahydropyrimidinyl-containing diaminoalkyl, β-aminoacids, α-aminoacids and derivatives thereof as factor Xa inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-07-31 | — | — | US | disclosed |