Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 3/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSV | O60911 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9107031 | 0.83 | S1PR1 (0.44) | PNMTSLC2A1CTSBADRB1ADRB3 | |
| SCHEMBL28805788 | 0.82 | OPRM1 (0.39) | TACR1AOC3MEN1KMT2A | |
| SCHEMBL22253022 | 0.78 | PNMT (0.46) | PNMTACP3TACR1SLC2A1AOC3 | |
| SCHEMBL27506218 | 0.78 | ACP3 (0.40) | PNMTACP3CHRM2CHRM1CHRM3 | |
| SCHEMBL27923790 | 0.75 | MEN1 (0.55) | ACP3CTSBCTSLCTSSCTSV | |
| SCHEMBL27607814 | 0.74 | ACP3 (0.40) | PNMTACP3CHRM2CHRM1CHRM3 | |
| SCHEMBL27609379 | 0.74 | OPRM1 (0.32) | PNMTACP3AOC3MEN1KMT2A | |
| SCHEMBL28753234 | 0.74 | HSD17B2 (0.33) | PNMTACP3AOC3KMT2AMAPT | |
| SCHEMBL27590975 | 0.74 | CHRM2 (0.32) | PNMTACP3CHRM2CHRM1CHRM3 | |
| SCHEMBL27590953 | 0.74 | HSD17B2 (0.33) | PNMTACP3AOC3KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103339107-A | Novel azetidine derivatives as sphingosine 1-phosphate (S1P) receptor modulators | ALLERGAN INC | 2013-10-02 | — | — | CN | disclosed |