Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.67 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.67 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.67 |
| ▸ | DRD1 | P21728 | 1/20 | 0.67 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.67 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.67 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.67 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.67 |
| ▸ | DRD3 | P35462 | 1/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.67 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.64 |
| ▸ | HTR7 | P34969 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21669406 | 0.92 | HTR1A (0.70) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL2527416 | 0.87 | HTR1A (0.66) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL11929304 | 0.86 | HTR1A (0.67) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL5654034 | 0.85 | HTR1A (0.66) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL2526228 | 0.85 | HTR1A (0.66) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL7056301 | 0.84 | HTR1A (0.63) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL11925192 | 0.82 | HTR1A (0.63) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL13533257 | 0.81 | HTR7 (0.61) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL7051736 | 0.81 | HTR1A (0.56) | HTR1AABCB11ADRA2AADORA3CHRM1 | |
| SCHEMBL21669397 | 0.81 | HTR1A (0.61) | HTR1AABCB11ADRA2AADORA3CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020026162-A1 | PROCESS FOR THE MULTISTEP CONTINUOUS-FLOW PREPARATION OF FLIBANSERIN | RICHTER GEDEON NYRT. (HU) | 2020-02-06 | — | — | WO | disclosed |