Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.47 |
| ▸ | KCNQ3 | O43525 | 3/20 | 0.46 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1016602 | 0.89 | CCR1 (0.48) | CCR1MEN1HCRTR1KMT2AKCNA5 | |
| SCHEMBL1019865 | 0.88 | CA1 (0.50) | CCR1ALDH1A1GAAHSD17B10MEN1 | |
| Hydrochloric Acid SCHEMBL1014557 | 0.88 | CCR1 (0.49) | CCR1ALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL3487251 | 0.82 | HSP90AA1 (0.52) | ALDH1A1GAAKMT2AKCNA5LMNA | |
| SCHEMBL1017419 | 0.79 | LMNA (0.44) | ALDH1A1GAALMNAHPGD | |
| Hydrochloric Acid SCHEMBL1019262 | 0.79 | MEN1 (0.41) | CCR1ALDH1A1HSD17B10MEN1HCRTR1 | |
| SCHEMBL1016166 | 0.78 | ALDH1A1 (0.50) | CCR1ALDH1A1MEN1KMT2AKCNA5 | |
| Hydrochloric Acid SCHEMBL1018237 | 0.78 | ALDH1A1 (0.45) | ALDH1A1GAAADRA1DMEN1KMT2A | |
| SCHEMBL1017517 | 0.77 | DDR1 (0.39) | ALDH1A1HSD17B10ADRA1DLMNAHPGD | |
| SCHEMBL15703882 | 0.77 | EPHX2 (0.46) | ALDH1A1ADRA1DKCNA5ROCK2LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2271624-A1 | IMINOPYRIDINE DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2011-01-12 | — | — | EP | claimed |
| WO-2009131245-A1 | IMINOPYRIDINE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-10-29 | — | — | WO | claimed |
| EP-2271624-A1 | IMINOPYRIDINE DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2011-01-12 | — | — | EP | disclosed |
| WO-2009131245-A1 | IMINOPYRIDINE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-10-29 | — | — | WO | disclosed |