Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | METAP1 | P53582 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HTR2B | P41595 | 4/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939388 | 0.89 | CYP19A1 (0.48) | SLC6A2SLC6A4SLC6A3CYP19A1METAP1 | |
| SCHEMBL14938930 | 0.88 | CYP19A1 (0.52) | CYP19A1MAOBL3MBTL1HTR2AHTR2C | |
| SCHEMBL14939596 | 0.84 | CYP19A1 (0.60) | SLC6A2SLC6A4SLC6A3CYP19A1METAP1 | |
| SCHEMBL14939233 | 0.81 | METAP1 (0.45) | SLC6A2SLC6A4SLC6A3CYP19A1METAP1 | |
| SCHEMBL14940109 | 0.78 | CYP19A1 (0.55) | SLC6A2SLC6A4SLC6A3CYP19A1MAOB | |
| SCHEMBL14939569 | 0.77 | HTR2A (0.41) | SLC6A2SLC6A4SLC6A3CYP19A1MAOB | |
| SCHEMBL10649546 | 0.77 | CYP19A1 (0.47) | CYP19A1METAP1L3MBTL1ALOX15KDM4E | |
| SCHEMBL14939220 | 0.77 | CYP19A1 (0.59) | CYP19A1METAP1L3MBTL1ALOX15ALOX12 | |
| SCHEMBL28815103 | 0.75 | CYP19A1 (0.48) | CYP19A1MAOBL3MBTL1HTR2AHTR2C | |
| SCHEMBL7836162 | 0.74 | NOS3 (0.49) | SLC6A4CYP19A1MAOBHTR2AHTR2C |
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 |