Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9477449 | 0.99 | ADRA2A (0.36) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| SCHEMBL9475100 | 0.91 | KMT2A (0.33) | ADRA2AACHEHTR1AADRA2BMAOA | |
| Hydrochloric Acid SCHEMBL9477098 | 0.90 | KMT2A (0.32) | ADRA2AHTR1AADRA2BMAOAHTR2B | |
| SCHEMBL9479120 | 0.88 | ABCC4 (0.37) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| Hydrochloric Acid SCHEMBL9477019 | 0.87 | ABCC4 (0.37) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| SCHEMBL9475534 | 0.84 | ADRB2 (0.36) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| Hydrochloric Acid SCHEMBL9476696 | 0.84 | ADRB2 (0.36) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| SCHEMBL9475901 | 0.83 | ACHE (0.38) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| Hydrochloric Acid SCHEMBL9476844 | 0.83 | ACHE (0.37) | ADRA2ASLC6A4ACHEABCC4ABCB11 | |
| SCHEMBL9476649 | 0.82 | ABCC4 (0.37) | ADRA2ASLC6A4ACHEABCC4ABCB11 |
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-5179089-A | Antiallergens, asthma | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1993-01-12 | — | — | US | claimed |
| EP-0486211-A1 | Isoquinoline derivatives | CHINOIN Gyògyszer és Vegyészeti Termékek Gyára RT. (HU) | 1992-05-20 | — | — | EP | claimed |