Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 3/20 | 0.33 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.31 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10515945 | 0.70 | CYP2A6 (0.39) | CYP2A6KDM4EALDH1A1 | |
| SCHEMBL28597830 | 0.70 | KDM4E (0.40) | CYP2A6KDM4EALDH1A1HSD17B10TSHR | |
| SCHEMBL15226099 | 0.70 | BRD4 (0.40) | ALDH1A1TSHRERN1 | |
| SCHEMBL4211114 | 0.68 | TUBB4A (0.45) | KDM4EALDH1A1HSD17B10HPGDPIM1 | |
| SCHEMBL586172 | 0.68 | CYP2A6 (0.42) | CYP2A6KDM4EALDH1A1PIM1 | |
| SCHEMBL15226107 | 0.68 | ALDH1A1 (0.42) | KDM4EALDH1A1HSD17B10PRMT6TSHR | |
| SCHEMBL5672634 | 0.66 | TAAR1 (0.41) | KEAP1TAAR1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL1309998 | 0.66 | KEAP1 (0.43) | KEAP1KDM4EALDH1A1TSHRHPGD | |
| SCHEMBL8120816 | 0.66 | ERN1 (0.43) | KEAP1TAAR1KDM4EALDH1A1PRMT6 | |
| SCHEMBL15226083 | 0.66 | CYP2A6 (0.37) | CYP2A6 |
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-2066632-B1 | BENZOPHENONE DERIVATIVES USEFUL FOR INHIBITING FORMATION OF MICROTUBULE | CHONG KUN DANG PHARM CORP (KR) | 2013-09-04 | — | — | EP | disclosed |