Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 9/20 | 0.44 |
| ▸ | DRD4 | P21917 | 4/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27492958 | 1.00 | HTR1A (0.44) | HTR1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL27494527 | 0.81 | MAPT (0.40) | HTR1ADRD4ADRA1ACYP3A4CYP2D6 | |
| SCHEMBL1554193 | 0.73 | CYP2D6 (0.49) | HTR1ADRD4ADRA1AADRA1BCYP2D6 | |
| SCHEMBL8303894 | 0.73 | HTR1A (0.57) | HTR1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL8299404 | 0.73 | HTR1A (0.57) | HTR1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL8298214 | 0.72 | HTR1A (0.54) | HTR1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL27492955 | 0.72 | HRH3 (0.37) | HTR1ACYP3A4MEN1KMT2A | |
| SCHEMBL8298272 | 0.72 | HTR1A (0.56) | HTR1ADRD4ADRA1AADRA1DADRA1B | |
| SCHEMBL28741347 | 0.69 | TRPM8 (0.45) | MEN1KMT2ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL27494111 | 0.68 | DRD2 (0.42) | ADRA1AMEN1KMT2ASMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1223650-A | Piperidines and pyrrolidines | MERCK PATENT GMBH (DE) | 1999-07-21 | — | — | CN | disclosed |