Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.42 |
| ▸ | CDK7 | P50613 | 1/20 | 0.42 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | CCNH | P51946 | 1/20 | 0.42 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 5/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | HTR7 | P34969 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30886776 | 0.89 | HTR6 (0.43) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL30886760 | 0.86 | CCNT1 (0.55) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL16655454 | 0.86 | CCNT1 (0.55) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL21234246 | 0.85 | LCK (0.42) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL16655163 | 0.85 | HTR6 (0.57) | EGFRCCNT1CDK9HTR6 | |
| Trifluoroacetic Acid SCHEMBL16654807 | 0.82 | HTR6 (0.41) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL20041226 | 0.81 | CCNT1 (0.61) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL26967533 | 0.81 | CCNT1 (0.61) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL18068876 | 0.80 | CCNK (0.42) | EGFRCCNT1CDK7CDK9CCNH | |
| SCHEMBL28545899 | 0.80 | EGFR (0.39) | EGFRCCNT1CDK7CDK9CCNH |
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-3057955-B1 | HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES | SYROS PHARMACEUTICALS INC (US) | 2018-04-11 | — | — | EP | disclosed |