Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL29028982 | 0.85 | KDM4E (0.57) | MRGPRX4KDM4EALOX15TSHRACMSD | |
| SCHEMBL31443034 | 0.84 | KDM4E (0.61) | MRGPRX4KDM4EALOX15TSHRACMSD | |
| SCHEMBL39745 | 0.84 | KDM4E (0.61) | MRGPRX4KDM4EALOX15TSHRACMSD | |
| Hydrochloric Acid SCHEMBL28435938 | 0.83 | KDM4E (0.59) | MRGPRX4KDM4EALOX15TSHRACMSD | |
| SCHEMBL1698714 | 0.82 | CYP1A2 (0.72) | CYP1A2MRGPRX4KDM4ETSHRMAPT | |
| Hydrochloric Acid SCHEMBL2959591 | 0.81 | CYP1A2 (0.70) | CYP1A2MRGPRX4KDM4ETSHRMAPT | |
| SCHEMBL4070470 | 0.76 | CYP1A2 (0.62) | CYP1A2MRGPRX4KDM4ETSHRMAPT | |
| Hydrochloric Acid SCHEMBL27689594 | 0.76 | CYP1A2 (0.54) | CYP1A2MRGPRX4KDM4ETSHRMAPT | |
| SCHEMBL979568 | 0.74 | KDM4E (0.61) | CYP1A2MRGPRX4KDM4EALOX15TSHR | |
| SCHEMBL458194 | 0.74 | MRGPRX4 (0.41) | CYP1A2MRGPRX4KDM4EALOX15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-101128430-A | Pyridine compounds for the treatment of prostaglandin mediated diseases | GLAXO GROUP LTD (GB) | 2008-02-20 | — | — | CN | disclosed |