Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KHK | P50053 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7399588 | 0.87 | METAP1 (0.45) | CNR1CNR2ALDH1A1KHKPLA2G2A | |
| SCHEMBL7401051 | 0.85 | DRD4 (0.42) | LMNAKHKPLA2G2AMAPT | |
| SCHEMBL7440853 | 0.84 | CNR1 (0.52) | CNR1CNR2MAOBLMNAALDH1A1 | |
| SCHEMBL7396359 | 0.81 | CNR1 (0.52) | CNR1CNR2LMNAALDH1A1CHRM1 | |
| Trifluoroacetic Acid SCHEMBL8698735 | 0.78 | SERPINE1 (0.41) | CNR2LMNAMAPT | |
| SCHEMBL5463293 | 0.67 | CNR1 (0.43) | CNR1CNR2LMNAALDH1A1CHRM1 | |
| SCHEMBL16944454 | 0.67 | SIGMAR1 (0.60) | ALDH1A1KMT2A | |
| SCHEMBL7398283 | 0.66 | MAPT (0.69) | ALDH1A1KHKMEN1KMT2AMAPT | |
| SCHEMBL10131759 | 0.65 | DCTPP1 (0.40) | CNR1CNR2LMNAALDH1A1MEN1 | |
| SCHEMBL8890453 | 0.65 | GAA (0.69) | LMNAALDH1A1KMT2AMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |
| US-5563141-A | INHIBIT CELL ADHESION FOR EXAMPLE, PLATELET AGGRE GATION | ZENECA LIMITED (GB) | 1996-10-08 | — | — | US | disclosed |