Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 4/20 | 0.36 |
| ▸ | F10 | P00742 | 4/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | FPR1 | P21462 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5569390 | 0.81 | P2RY1 (0.42) | P2RY1FPR2F10F2ALDH1A1 | |
| SCHEMBL5567510 | 0.76 | AAK1 (0.50) | P2RY1ALDH1A1MAPTNPSR1 | |
| SCHEMBL17152485 | 0.72 | TGM2 (0.49) | ALDH1A1MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL5570741 | 0.72 | F10 (0.48) | P2RY1F10F2NPSR1SLC6A2 | |
| SCHEMBL5567235 | 0.72 | F10 (0.48) | P2RY1F10F2ALDH1A1NPSR1 | |
| SCHEMBL5569392 | 0.72 | CHEK1 (0.49) | P2RY1 | |
| SCHEMBL5569965 | 0.71 | F10 (0.45) | P2RY1FPR2F10F2ALDH1A1 | |
| SCHEMBL5570412 | 0.71 | P2RY1 (0.46) | P2RY1ALDH1A1MAPTNPSR1KDM4E | |
| SCHEMBL18421181 | 0.71 | HRH3 (0.45) | ALDH1A1MAPTKDM4EL3MBTL1SMN1; SMN2 | |
| SCHEMBL17152538 | 0.70 | TGM2 (0.54) | ALDH1A1MAPTHTTL3MBTL1NPC1 |
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 |