Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | CTSC | P53634 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL25415116 | 0.83 | MAOA (0.44) | MAOAMAOBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7276325 | 0.75 | KDM1A (0.46) | MAOAMAOBKDM1ATAAR1 | |
| SCHEMBL582586 | 0.75 | TSHR (0.44) | CTSLCTSBCTSKTAAR1 | |
| SCHEMBL23809773 | 0.73 | CARM1 (0.45) | MAOAMAOBCTSLCTSBCTSS | |
| SCHEMBL1609623 | 0.72 | MAOA (0.58) | MAOAMAOBCTSLCTSBCTSS | |
| SCHEMBL15295395 | 0.72 | MAOA (0.50) | MAOAMAOBKDM1ASLC6A2SLC6A4 | |
| SCHEMBL25412651 | 0.71 | MAOA (0.40) | MAOAMAOBCTSLCTSBCTSS | |
| SCHEMBL16572196 | 0.71 | TAAR1 (0.49) | MAOAMAOBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16985344 | 0.70 | CTSL (0.45) | CTSLCTSBCTSSCTSKCTSC | |
| SCHEMBL7616968 | 0.69 | OPRM1 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2940019-B1 | SUBSTITUTED SPIROPYRIDO[1,2-a]PYRAZINE DERIVATIVE AND MEDICINAL USE THEREOF AS HIV INTEGRASE INHIBITOR | JAPAN TOBACCO INC (JP) | 2018-03-28 | — | — | EP | disclosed |