Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11369826 | 0.85 | KMT2A (0.36) | KMT2ASLC6A2SLC6A3CHRNB4CHRNA3 | |
| SCHEMBL28818918 | 0.78 | KMT2A (0.48) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL27795012 | 0.76 | KMT2A (0.44) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL2360743 | 0.74 | KMT2A (0.43) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL3835020 | 0.74 | LMNA (0.43) | KMT2ACYP2C19LMNATHRBALDH1A1 | |
| SCHEMBL4958805 | 0.71 | CYP1A2 (0.38) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL16318595 | 0.70 | CYP2C19 (0.43) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL27470889 | 0.68 | KMT2A (0.39) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL9531382 | 0.68 | KMT2A (0.42) | KMT2ACYP2C19LMNATHRBCYP1A2 | |
| SCHEMBL21775519 | 0.68 | OPRK1 (0.38) | KMT2ACYP2C19LMNATHRBCYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1307226-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | Bristol-Myers Squibb Pharma Company (US) | 2003-05-07 | — | — | EP | claimed |
| WO-2001097848-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-12-27 | — | — | WO | claimed |