Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 17/20 | 0.43 |
| ▸ | HTR1D | P28221 | 17/20 | 0.43 |
| ▸ | HTR1B | P28222 | 17/20 | 0.43 |
| ▸ | DRD2 | P14416 | 8/20 | 0.42 |
| ▸ | HTR7 | P34969 | 8/20 | 0.42 |
| ▸ | DRD3 | P35462 | 8/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.42 |
| ▸ | HTR2A | P28223 | 7/20 | 0.42 |
| ▸ | HTR2B | P41595 | 7/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 6/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27650461 | 0.99 | ADRA1A (0.42) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL27670574 | 0.92 | HTR1A (0.44) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL27650450 | 0.85 | HTR1A (0.61) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL2884411 | 0.79 | HTR1A (0.65) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| Hydrochloric Acid SCHEMBL2884192 | 0.77 | HTR1D (0.54) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL27650507 | 0.77 | HTR1D (0.53) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| Hydrochloric Acid SCHEMBL2885896 | 0.76 | HTR1D (0.69) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| Hydrochloric Acid SCHEMBL2884177 | 0.76 | HTR1D (0.53) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| Hydrochloric Acid SCHEMBL2884542 | 0.76 | HTR1A (0.68) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| Hydrochloric Acid SCHEMBL27650488 | 0.76 | HTR1A (0.56) | HTR1AHTR1DHTR1BDRD2HTR7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100441571-C | Quinoline and quinazoline derivatives having affinity for 5HT1-type receptors | GLAXO GROUP LTD (GB) | 2008-12-10 | — | — | CN | claimed |
| CN-1852896-A | Quinoline and quinazoline derivatives having affinity for 5HT 1-type receptors | GLAXO GROUP LTD (GB) | 2006-10-25 | — | — | CN | claimed |
| CN-100441571-C | Quinoline and quinazoline derivatives having affinity for 5HT1-type receptors | GLAXO GROUP LTD (GB) | 2008-12-10 | — | — | CN | disclosed |
| CN-1852896-A | Quinoline and quinazoline derivatives having affinity for 5HT 1-type receptors | GLAXO GROUP LTD (GB) | 2006-10-25 | — | — | CN | disclosed |