Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 9/20 | 0.47 |
| ▸ | CCND1 | P24385 | 9/20 | 0.47 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.42 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.42 |
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.41 |
| ▸ | GABRE | P78334 | 1/20 | 0.41 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.41 |
| ▸ | GABRG1 | Q8N1C3 | 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 | |
|---|---|---|---|---|
| SCHEMBL2368350 | 0.77 | CYP1A1 (0.57) | CYP1A1CYP1B1HPGDALDH1A1KDM4E | |
| SCHEMBL12278524 | 0.76 | CYP1A1 (0.56) | CYP1A1CYP1B1HPGDALDH1A1KDM4E | |
| SCHEMBL23555964 | 0.74 | CYP1A1 (0.54) | CYP1A1CYP1B1HPGDALDH1A1KDM4E | |
| SCHEMBL14653387 | 0.73 | GABRP (0.49) | CDK4CCND1IMPDH2IMPDH1GABRP | |
| SCHEMBL18429728 | 0.73 | CYP1A1 (0.50) | CYP1A1CYP1B1HPGDALDH1A1HSD17B10 | |
| SCHEMBL16574518 | 0.73 | CYP1A1 (0.53) | CYP1A1CYP1B1ALDH1A1KDM4ELMNA | |
| SCHEMBL23264295 | 0.73 | CYP1A1 (0.53) | CYP1A1CYP1B1HPGDALDH1A1KDM4E | |
| SCHEMBL23264294 | 0.73 | CYP1A1 (0.53) | CYP1A1CYP1B1HPGDALDH1A1KDM4E | |
| SCHEMBL15542345 | 0.72 | ALDH1A1 (0.44) | CDK4CCND1IMPDH2IMPDH1GABRP | |
| SCHEMBL11933063 | 0.72 | GABRP (0.58) | CDK4CCND1IMPDH2IMPDH1GABRP |
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-2894157-A1 | Condensed cyclic compound and organic light-emitting device including the same | Samsung Electronics Co., Ltd (KR) | 2015-07-15 | — | — | EP | disclosed |