Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31186222 | 0.81 | CYP1A2 (0.53) | CYP1A2MAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL22335924 | 0.77 | CYP1A2 (0.64) | CYP1A2MAPTCYP4F2CYP4A11NPC1 | |
| SCHEMBL22070741 | 0.76 | CYP1A2 (0.62) | CYP1A2MAPTCYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL1179292 | 0.75 | CYP1A2 (0.65) | CYP1A2MAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL2448187 | 0.72 | CYP1A2 (0.61) | CYP1A2MAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL18096040 | 0.72 | CYP1A2 (0.61) | CYP1A2MAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL22335907 | 0.72 | MEN1 (0.49) | CYP1A2MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL18137624 | 0.72 | CYP1A2 (0.56) | CYP1A2MAPTNPC1ALDH1A1RAB9A | |
| SCHEMBL22335927 | 0.71 | CYP1A2 (0.44) | CYP1A2MAPTCYP4F2CYP4A11NPC1 | |
| SCHEMBL22325482 | 0.71 | CYP4A11 (0.47) | CYP4F2CYP4A11MEN1KMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020162612-A1 | PYRIDINE COMPOUND SUBSTITUTED BY HETEROARYL | 大正製薬株式会社 | 2020-08-13 | — | — | WO | disclosed |