Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CA7 | P43166 | 3/20 | 0.51 |
| ▸ | CA9 | Q16790 | 3/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.51 |
| ▸ | P4HB | P07237 | 2/20 | 0.47 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.46 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | FASN | P49327 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TCF4 | P15884 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10420733 | 0.85 | P4HB (0.60) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2892627 | 0.83 | TSHR (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31208002 | 0.82 | CA12 (0.76) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2259905 | 0.82 | CA12 (0.76) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10506033 | 0.81 | TDP1 (0.63) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9828457 | 0.81 | CA12 (0.63) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5733350 | 0.79 | L3MBTL1 (0.69) | LOXL2TSHRCYP4F2CYP4A11TDP1 | |
| SCHEMBL2339850 | 0.79 | TSHR (0.61) | CA12CA1CA2CA7CA9 | |
| Methyl 3-Hydroxybenzoate SCHEMBL67203 | 0.78 | P4HB (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL40429 | 0.78 | GPR17 (0.65) | GPR17LOXL2TSHRCYP4F2CYP4A11 |
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 |
|---|---|---|---|---|---|---|---|
| US-4920133-A | Quinoline derivatives and use thereof as antagonists of leukotriene D4 | RORER PHARMACEUTICAL CORP. (US) | 1990-04-24 | — | — | US | disclosed |