Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.86 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.86 |
| ▸ | DRD3 | P35462 | 2/20 | 0.86 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.86 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.86 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.86 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.86 |
| ▸ | DRD1 | P21728 | 1/20 | 0.86 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.86 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.86 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.86 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.86 |
| ▸ | HTR7 | P34969 | 13/20 | 0.74 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL8121534 | 0.99 | HTR1A (0.88) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| SCHEMBL8121051 | 0.97 | HTR1A (0.88) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL29399513 | 0.93 | HTR1A (1.00) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL247579 | 0.93 | HTR1A (1.00) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL30249132 | 0.93 | HTR1A (1.00) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL19743151 | 0.92 | HTR1A (0.98) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL563586 | 0.92 | HTR1A (0.98) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL2526226 | 0.92 | HTR1A (0.98) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| Flibanserin SCHEMBL19743166 | 0.92 | HTR1A (0.98) | HTR1AADRA1ADRD3ABCB11ADRA2A | |
| SCHEMBL8123196 | 0.89 | HTR1A (0.92) | HTR1AADRA1ADRD3ABCB11ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5576318-A | FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | BOEHRINGER INGELHEIM ITALIA S.P.A. (IT) | 1996-11-19 | — | — | US | disclosed |