Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9813337 | 0.86 | ADORA3 (0.42) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL19706483 | 0.85 | AAK1 (0.49) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL19706486 | 0.85 | AAK1 (0.49) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL19736137 | 0.83 | TSHR (0.40) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL19736139 | 0.83 | TSHR (0.40) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL9813335 | 0.81 | MAPK8 (0.45) | TSHRMAPK1MEN1KMT2AADORA3 | |
| SCHEMBL19706513 | 0.80 | PTK2 (0.48) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL19706701 | 0.80 | PTK2 (0.48) | TSHRMAPK1ADRB2ADRB1ADRB3 | |
| SCHEMBL9852316 | 0.78 | ADORA3 (0.48) | ADORA3L3MBTL1MAPK8PRKD3ADORA2A | |
| SCHEMBL19706530 | 0.78 | TSHR (0.44) | TSHRMAPK1ADRB2ADRB1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0434576-A1 | Thermotropic adducts from non-mesogenic species bound by hydrogen bonds and method for their preparation | RHONE-POULENC CHIMIE (FR) | 1991-06-26 | — | — | EP | disclosed |