Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.39 |
| ▸ | FPR2 | P25090 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 4/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL5570412 | 0.84 | P2RY1 (0.46) | P2RY1KCNQ2MEN1KMT2AALDH1A1 | |
| SCHEMBL5566711 | 0.81 | MAPT (0.44) | P2RY1KCNQ2FPR2MEN1KMT2A | |
| SCHEMBL5567510 | 0.76 | AAK1 (0.50) | P2RY1ALDH1A1MAPT | |
| SCHEMBL5569965 | 0.76 | F10 (0.45) | P2RY1FPR2MEN1KMT2AALDH1A1 | |
| SCHEMBL5566695 | 0.75 | KMT2A (0.43) | KCNQ2MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL5570588 | 0.75 | ULK1 (0.40) | P2RY1KCNQ2MEN1KMT2AALDH1A1 | |
| SCHEMBL5569392 | 0.74 | CHEK1 (0.49) | P2RY1 | |
| SCHEMBL5569500 | 0.71 | OPRK1 (0.45) | OPRK1 | |
| SCHEMBL5565619 | 0.69 | CNR1 (0.51) | P2RY1ALDH1A1MAPT | |
| SCHEMBL4518392 | 0.69 | HDAC4 (0.56) | MEN1KMT2ASMN1; 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 |