Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | KCNK3 | O14649 | 7/20 | 0.52 |
| ▸ | KCNK9 | Q9NPC2 | 7/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30022715 | 0.91 | ALDH1A1 (0.56) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL30023178 | 0.89 | ALDH1A1 (0.60) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL30557936 | 0.89 | ABCB1 (0.54) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL28885757 | 0.87 | ABCB1 (0.61) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL30557933 | 0.87 | CYP3A4 (0.56) | ALDH1A1NPSR1CYP3A4KCNK3KCNK9 | |
| SCHEMBL30557937 | 0.87 | ABCB1 (0.55) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL30557945 | 0.86 | ABCB1 (0.52) | ALDH1A1NPSR1KMT2AATMKCNK3 | |
| SCHEMBL30023054 | 0.86 | ALDH1A1 (0.56) | ALDH1A1NPSR1CYP3A4KMT2AATM | |
| SCHEMBL30557942 | 0.85 | ABCB1 (0.55) | ALDH1A1NPSR1CYP3A4KCNK3KCNK9 | |
| SCHEMBL30023553 | 0.85 | ALDH1A1 (0.55) | ALDH1A1NPSR1CYP3A4KMT2AATM |
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-115160313-B | 2-phenylimidazole [1,2-a ] pyridine compound, composition containing same and application of 2-phenylimidazole [1,2-a ] pyridine compound and composition | 中国药科大学 | 2023-09-05 | — | — | CN | disclosed |