Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 3/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.33 |
| ▸ | CDK2 | P24941 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.32 |
| ▸ | CDK4 | P11802 | 2/20 | 0.32 |
| ▸ | CCND1 | P24385 | 2/20 | 0.32 |
| ▸ | CDK9 | P50750 | 2/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 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 | |
|---|---|---|---|---|
| SCHEMBL1172667 | 0.98 | — | — | |
| SCHEMBL11318233 | 0.73 | CYP1A2 (0.53) | MAPTLMNACYP1A2CYP2C9KDM4E | |
| SCHEMBL1172467 | 0.71 | CYP1A2 (0.40) | MAPTCYP1A2CYP2C9ALPL | |
| Potassium Ion SCHEMBL6131368 | 0.70 | CYP1A2 (0.39) | MAPTCYP1A2CYP2C9ALPL | |
| Ammonia Solution, Strong SCHEMBL9727420 | 0.70 | CYP1A2 (0.39) | MAPTCYP1A2CYP2C9ALPL | |
| SCHEMBL2160351 | 0.70 | — | — | |
| SCHEMBL6131347 | 0.70 | CYP1A2 (0.39) | MAPTCYP1A2CYP2C9ALPL | |
| Potassium SCHEMBL6131371 | 0.70 | CYP1A2 (0.39) | MAPTCYP1A2CYP2C9ALPL | |
| SCHEMBL6131346 | 0.70 | CYP1A2 (0.36) | CYP1A2CYP2C9 | |
| SCHEMBL15643552 | 0.68 | CYP1A2 (0.38) | CYP1A2CYP2C9CCNE2CCNE1CDK2 |
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-0320370-B1 | 4,6-Di-(3-amine-5-nitro-1,2,4-triazol)-5-nitropyrimidine derivative, process for its preparation and explosive material containing it | COMMISSARIAT ENERGIE ATOMIQUE (FR) | 1993-11-10 | — | — | EP | claimed |