Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 4/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PTPRF | P10586 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL9636881 | 0.87 | SLC18A3 (0.46) | SLC18A3SIGMAR1HTR2CBCHEHTR6 | |
| SCHEMBL15551111 | 0.84 | PTPN1 (0.53) | CES1MAOAPTPN1BCHEPTPRC | |
| SCHEMBL16393502 | 0.74 | HTR6 (0.37) | CES1MAOAPTPN1PTPRCPTPRF | |
| SCHEMBL4131664 | 0.72 | CES1 (0.38) | CES1MAOAPTPN1BCHEPTPRC | |
| SCHEMBL27546304 | 0.71 | PTPN1 (0.44) | MAOAPTPN1BCHEPTPRCPTPRF | |
| SCHEMBL16339665 | 0.69 | PTPN1 (0.46) | MAOAPTPN1BCHEPTPRCPTPRF | |
| SCHEMBL11574438 | 0.67 | SIGMAR1 (0.38) | SLC18A3SIGMAR1HTR2CHTR2BBCHE | |
| Anthrone SCHEMBL28063735 | 0.66 | MAOA (0.78) | CES1MAOAHTR2CBCHECDC25B | |
| SCHEMBL14054414 | 0.65 | MAOA (0.50) | CES1MAOABCHEPTPRCCDC25B | |
| SCHEMBL2566227 | 0.65 | CES1 (0.50) | CES1MAOABCHECDC25B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288563-B1 | CYCLIC AMINE DERIVATIVES | EISAI CO LTD (JP) | 1994-05-11 | — | — | EP | disclosed |
| US-4921863-A | Cyclic amine derivatives | EISAI CO., LTD. (JP) | 1990-05-01 | — | — | US | disclosed |
| EP-0288563-A1 | CYCLIC AMINE DERIVATIVES | Eisai Co., Ltd. (JP) | 1988-11-02 | — | — | EP | disclosed |