Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 6/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939569 | 0.86 | HTR2A (0.41) | CYP19A1MAOBACHEBCHESLC6A2 | |
| SCHEMBL14939508 | 0.85 | ACHE (0.45) | METAP1CYP19A1ACHEALDH1A1NPC1 | |
| SCHEMBL14939596 | 0.82 | CYP19A1 (0.60) | METAP1CYP19A1MAOBACHEALDH1A1 | |
| SCHEMBL14939619 | 0.81 | SLC6A2 (0.52) | METAP1CYP19A1ALOX15ALOX12MAOB | |
| SCHEMBL14939388 | 0.76 | CYP19A1 (0.48) | METAP1CYP19A1ALOX15ALOX12MAOB | |
| SCHEMBL10649546 | 0.75 | CYP19A1 (0.47) | METAP1CYP19A1ALOX15POLBMAPT | |
| SCHEMBL14939220 | 0.75 | CYP19A1 (0.59) | METAP1CYP19A1ALOX15ALOX12ACHE | |
| SCHEMBL14939102 | 0.73 | ACHE (0.47) | METAP1CYP19A1ACHEALDH1A1NPC1 | |
| SCHEMBL5953324 | 0.70 | CYP1A2 (0.44) | METAP1CYP19A1ACHEALDH1A1NPC1 | |
| SCHEMBL13891933 | 0.70 | CYP19A1 (0.58) | METAP1CYP19A1MAOBACHEALDH1A1 |
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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |