Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 12/20 | 0.58 |
| ▸ | TACR2 | P21452 | 10/20 | 0.58 |
| ▸ | TACR3 | P29371 | 6/20 | 0.58 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8594002 | 0.83 | TACR1 (0.46) | TACR1TACR2TACR3ADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL8368423 | 0.83 | TACR1 (0.53) | TACR1TACR2TACR3 | |
| SCHEMBL8559945 | 0.80 | TACR2 (0.60) | TACR1TACR2TACR3HTR7 | |
| SCHEMBL8558380 | 0.79 | HPGD (0.40) | TACR1TACR2 | |
| SCHEMBL8559948 | 0.76 | TACR2 (0.55) | TACR1TACR2TACR3HTR7ADRA2A | |
| Hydrochloric Acid SCHEMBL8593049 | 0.75 | CCR3 (0.42) | TACR1MEN1KMT2A | |
| SCHEMBL8556923 | 0.74 | TACR2 (0.58) | TACR1TACR2TACR3ADRA2AADRA2B | |
| SCHEMBL8561168 | 0.74 | PDE4A (0.40) | TACR1TACR2 | |
| SCHEMBL7844998 | 0.73 | TACR1 (1.00) | TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL8368100 | 0.72 | TACR2 (0.47) | TACR1TACR2TACR3 |
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-5807865-A | 3,3-disubstituted piperidine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LIMITED (GB) | 1998-09-15 | — | — | US | disclosed |