Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.33 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9800426 | 0.88 | CYP19A1 (0.38) | CA2CYP19A1ADRB2HTR1DSYK | |
| SCHEMBL5918471 | 0.82 | ADRB2 (0.56) | CA2ADRB2HTR1DMETCA1 | |
| SCHEMBL10465857 | 0.81 | CACNB4 (0.46) | ALDH1A1HTR6CACNA1H | |
| Hydrochloric Acid SCHEMBL7558473 | 0.81 | ADRB2 (0.54) | CA2ADRB2HTR1DMETCA1 | |
| SCHEMBL5918480 | 0.81 | ADRB2 (0.42) | CA2CYP19A1ADRB2HTR1DMET | |
| SCHEMBL9765108 | 0.81 | ADRB2 (0.42) | CA2ADRB2HTR1DMETCA1 | |
| SCHEMBL10465308 | 0.80 | CACNB4 (0.42) | CYP19A1ALDH1A1MEN1KMT2AHTR6 | |
| SCHEMBL10494711 | 0.80 | ADRB2 (0.47) | CA2ADRB2HTR1DMETCA1 | |
| SCHEMBL10464728 | 0.79 | EGFR (0.41) | CA2ADRB2CA1CA5ACA9 | |
| SCHEMBL10465880 | 0.79 | PLA2G2A (0.47) | HTR6MTNR1AMTNR1B |
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-5037845-A | Analgesics; for treatment or prevention of pain due to vasodilation in the cranium | GLAXO GROUP LIMITED (GB) | 1991-08-06 | — | — | US | disclosed |
| US-4816470-A | Heterocyclic compounds | GLAXO GROUP LIMITED | 1989-03-28 | — | — | US | disclosed |