Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.49 |
| ▸ | HTR2B | P41595 | 3/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | RET | P07949 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.41 |
| ▸ | ITGAL | P20701 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8913519 | 0.89 | ALDH1A1 (0.45) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL6840810 | 0.83 | SIGMAR1 (0.51) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL8778972 | 0.81 | HTR2A (0.49) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL8913172 | 0.81 | SIGMAR1 (0.47) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL6836358 | 0.78 | SIGMAR1 (0.58) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL6841697 | 0.78 | ADRA2A (0.47) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL9451756 | 0.77 | SIGMAR1 (0.71) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL8913831 | 0.76 | HTR2A (0.42) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL3982285 | 0.76 | CA1 (0.47) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL2310023 | 0.74 | ALDH1A1 (0.55) | ALDH1A1HPGDLMNARAB9ABAZ2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |
| EP-0431943-A2 | Nitrogen-containing spirocycles | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |