Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.40 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 4/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 4/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 3/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5740933 | 0.95 | HTR2A (0.38) | HTR1AHTR1DHTR1BPARP1SIGMAR1 | |
| SCHEMBL5738682 | 0.84 | SIGMAR1 (0.38) | HTR1AHTR1DHTR1BSIGMAR1DRD2 | |
| SCHEMBL6399207 | 0.84 | HTR2A (0.50) | HTR1ASIGMAR1DRD2HTR2AHTR7 | |
| SCHEMBL5738711 | 0.80 | MEN1 (0.39) | HTR1A | |
| SCHEMBL6401030 | 0.79 | HTR7 (0.52) | DRD2HTR2AHTR7DRD4 | |
| SCHEMBL6401515 | 0.78 | HTR1A (0.56) | HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL5784362 | 0.78 | HTR1A (0.31) | HTR1ADRD2HTR2A | |
| SCHEMBL5738767 | 0.78 | HTR2A (0.51) | HTR1ADRD2HTR2A | |
| SCHEMBL5750335 | 0.78 | HTR1A (0.39) | HTR1AHTR1DHTR1BDRD2HTR2C | |
| SCHEMBL5738687 | 0.75 | HTR1A (0.41) | HTR1AHTR1DHTR1BDRD2HTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1697334-A1 | HETEROCYCLIC SUBSTITUTED INDANE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA | Warner-Lambert Company LLC (US) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005056540-A1 | HETEROCYCLIC SUBSTITUTED INDANE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA | WARNER-LAMBERT COMPANY LLC (US) | 2005-06-23 | — | — | WO | disclosed |