Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 2/20 | 0.38 |
| ▸ | HTR6 | P50406 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9134839 | 0.98 | ADRA1D (0.42) | HTR1ACHRM2CHRM3ADRA1DADRA1A | |
| SCHEMBL9132145 | 0.97 | HTR1A (0.42) | HTR1ACHRM2CHRM3ADRA1DADRA1A | |
| SCHEMBL9130405 | 0.94 | HTR2A (0.38) | CHRM2CHRM3HTR2AHTR7 | |
| SCHEMBL9131309 | 0.90 | HTR1A (0.51) | HTR1AADRA1DADRA1AADRA1BDRD2 | |
| SCHEMBL9134836 | 0.89 | DRD2 (0.52) | HTR1AADRA1DADRA1AADRA1BDRD2 | |
| SCHEMBL9132141 | 0.88 | DRD2 (0.53) | HTR1AADRA1DADRA1AADRA1BDRD2 | |
| SCHEMBL9129907 | 0.87 | HTR1A (0.50) | HTR1ACHRM2CHRM3ADRA1DADRA1A | |
| SCHEMBL9131296 | 0.87 | HTR1A (0.51) | HTR1ACHRM2CHRM3ADRA1DADRA1A | |
| SCHEMBL9129953 | 0.85 | HTR1A (0.52) | HTR1ACHRM2CHRM3ADRA1DADRA1A | |
| SCHEMBL9129940 | 0.85 | HTR2A (0.40) | HTR1AADRA1DADRA1AADRA1BDRD2 |
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-5453437-A | 1,3-disubstituted pyrrolidines | BAYER AKTIENGESELLSCHAFT (DE) | 1995-09-26 | — | — | US | disclosed |
| US-5274097-A | A 1-N-heterocyclic alkylene-3-carbo or heterocyclic ring oxypyrrolidine derivative | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-28 | — | — | US | disclosed |
| US-5037841-A | For treating nervous system disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1991-08-06 | — | — | US | disclosed |