Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14410044 | 0.71 | MAOA (0.40) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL1006026 | 0.69 | — | — | |
| SCHEMBL15133421 | 0.69 | — | — | |
| SCHEMBL13953860 | 0.67 | MAPK1 (0.32) | KMT2A | |
| SCHEMBL6055699 | 0.67 | HIF1A (0.39) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL11130669 | 0.67 | HIF1A (0.39) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL3404238 | 0.67 | HIF1A (0.39) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL3407463 | 0.67 | HIF1A (0.39) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL5626714 | 0.61 | ALDH1A1 (0.33) | MAOAMAOBCYP2A6 | |
| SCHEMBL14502282 | 0.60 | KDM4E (0.30) | — |
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-2010003475-A2 | NOVEL PYRROLIDONE DERIVATIVES FOR USE AS METAP-2 INHIBITORS | MERCK PATENT GMBH (DE) | 2010-01-14 | — | — | WO | disclosed |