Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 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 | |
|---|---|---|---|---|
| SCHEMBL29544498 | 0.82 | GAA (0.47) | ALDH1A1GAAMAPTKDM4EHSP90AA1 | |
| SCHEMBL29544132 | 0.79 | MGLL (0.43) | ALDH1A1GAAMAPTKDM4EHPGD | |
| SCHEMBL14738518 | 0.78 | MEN1 (0.41) | ALDH1A1GAAKDM4EHPGDNPC1 | |
| SCHEMBL3546699 | 0.77 | NPC1 (0.49) | ALDH1A1MAPTHSP90AA1HPGDNPC1 | |
| SCHEMBL3546695 | 0.77 | NPC1 (0.49) | ALDH1A1MAPTHSP90AA1HPGDNPC1 | |
| SCHEMBL23889196 | 0.76 | KIT (0.42) | ALDH1A1GAAMAPTKDM4EHPGD | |
| SCHEMBL20646782 | 0.76 | MGLL (0.41) | ALDH1A1GAAKDM4ENPC1RAB9A | |
| SCHEMBL14739394 | 0.73 | GAA (0.50) | ALDH1A1GAAMAPTKDM4EHPGD | |
| SCHEMBL23245952 | 0.73 | CYP1A2 (0.49) | ALDH1A1MAPTHPGDTDP1HTT | |
| SCHEMBL28718664 | 0.71 | CYP1A2 (0.43) | ALDH1A1GAAMAPTKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-114269742-B | Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridinyl) pyrimidin-2-amine as therapeutic agents | 常州千红生化制药股份有限公司 | 2024-07-16 | — | — | CN | disclosed |
| EP-3997088-A1 | DERIVATIVES OF 4-(IMIDAZO[L,2-A]PYRIDIN-3-YL)-N-(PYRIDINYL)PYRIMIDIN- 2-AMINE AS THERAPEUTIC AGENTS | Aucentra Therapeutics Pty Ltd (AU) | 2022-05-18 | — | — | EP | disclosed |