Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.60 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8190422 | 0.87 | HRH3 (0.52) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8190429 | 0.84 | CHRNA7 (0.61) | HRH3ADRA2AADRA2BADRA2CPRMT5 | |
| SCHEMBL8192754 | 0.83 | ADRA2A (0.51) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8185348 | 0.83 | S1PR5 (0.60) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8190334 | 0.83 | HRH3 (0.58) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL10571355 | 0.82 | HRH3 (0.54) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8190341 | 0.81 | HRH3 (0.56) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8189400 | 0.79 | HRH3 (0.49) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8187058 | 0.78 | ADRA2A (0.57) | S1PR5HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL8192779 | 0.78 | HRH3 (0.53) | S1PR5HRH3ADRA2AADRA2BADRA2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6096752-A | Method for the preparation of tertiary amines, a compound useful therefor and alpha-2-receptor active tetrahydroisoquinoline derivatives | HEINONEN PETRI (FI) | 2000-08-01 | — | — | US | disclosed |
| US-5912342-A | SYNTHESIS OF COMBINATORIAL LIBRARIES BY COMPUTER CONTROLLED ROBOT | HEINONEN PETRI (FI) | 1999-06-15 | — | — | US | disclosed |