Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.67 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.65 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.61 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.61 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.61 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CDC25A | P30304 | 1/20 | 0.55 |
| ▸ | CDC25C | P30307 | 1/20 | 0.55 |
| ▸ | F3 | P13726 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4774104 | 0.95 | MAOB (0.74) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL27846203 | 0.86 | MAPT (0.73) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL27846201 | 0.86 | MAPT (0.73) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL29090933 | 0.82 | CYP1A1 (0.58) | MAOBTNFRSF1AABCG2MAPTLMNA | |
| SCHEMBL5479178 | 0.81 | MAOB (1.00) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL5479175 | 0.81 | MAOB (1.00) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL1390301 | 0.80 | MAOB (0.55) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL5915590 | 0.80 | MAOB (0.55) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| SCHEMBL5915902 | 0.80 | MAOB (0.55) | MAOBTNFRSF1AGABRA3GABRA2GABRB2 | |
| P-Methoxy-Acetophenone SCHEMBL4774853 | 0.80 | MEN1 (0.65) | MAOBTNFRSF1AABCG2MAPTLMNA |
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-2008006626-A1 | TRIPHENYL MODIFIED 5-MEMBERED HETEROCYCLES AND THEIR USE AS ANTICANCER AND ANTIINFLAMMATORY AGENTS | FREIE UNIVERSITÄT BERLIN (DE) | 2008-01-17 | — | — | WO | disclosed |