Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPE | Q05469 | 4/20 | 0.47 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL5035238 | 0.91 | LIPE (0.45) | LIPECNR1CNR2 | |
| SCHEMBL14190186 | 0.85 | CNR1 (0.44) | LIPECNR1CYP3A4RAB9AHRH4 | |
| SCHEMBL5039110 | 0.82 | CYP3A4 (0.42) | CYP3A4RAB9ATDP1ALDH1A1KDM4E | |
| SCHEMBL5041330 | 0.80 | CYP3A4 (0.44) | CNR1CYP3A4RAB9AALDH1A1KDM4E | |
| SCHEMBL5036060 | 0.79 | CYP3A4 (0.43) | CYP3A4RAB9AKDM4EHPGDKMT2A | |
| SCHEMBL5039118 | 0.78 | MCHR1 (0.41) | CYP3A4CYP11B1CYP11B2 | |
| SCHEMBL5032685 | 0.78 | GABRA2 (0.46) | CYP3A4RAB9AHRH4ALDH1A1HPGD | |
| SCHEMBL5039137 | 0.78 | POLB (0.40) | LIPECYP3A4RAB9AALDH1A1KDM4E | |
| SCHEMBL5032567 | 0.77 | CYP3A4 (0.49) | CNR1CYP3A4RAB9ACNR2ALDH1A1 | |
| SCHEMBL5034899 | 0.77 | NLRP3 (0.38) | CYP3A4KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1694673-B1 | THIAZOLE DERIVATES | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | claimed |