Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844176 | 0.82 | ADORA3 (0.35) | ADORA1AURKA | |
| SCHEMBL17844227 | 0.78 | POLB (0.39) | LMNAALDH1A1HTTSMN1; SMN2AURKA | |
| SCHEMBL3551960 | 0.76 | BRD4 (0.39) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL5261593 | 0.74 | MAPT (0.40) | CYP1A2LMNAALDH1A1TAAR1TDP1 | |
| SCHEMBL17844148 | 0.73 | KMT2A (0.40) | ALDH1A1TDP1RAB9ANPC1HTT | |
| SCHEMBL17844175 | 0.73 | CA12 (0.38) | ALDH1A1CYP2C19 | |
| SCHEMBL17844195 | 0.71 | ASPH (0.41) | MKNK1MAOBALDH1A1ALOX15TDP1 | |
| SCHEMBL17844088 | 0.71 | KDM4E (0.40) | CYP1A2LMNAALDH1A1ALOX15TDP1 | |
| SCHEMBL2002898 | 0.68 | NR1H2 (0.47) | MKNK1CYP1A2MAOBHRH3LMNA | |
| SCHEMBL28731705 | 0.65 | CYP1A2 (0.60) | CYP1A2HRH3LMNAALDH1A1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016100619-A2 | TREATMENT AND DIAGNOSIS OF CANCER | RGENIX, INC. (US) | 2016-06-23 | — | — | WO | disclosed |