Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 4/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 2/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2488514 | 0.86 | ADORA1 (0.46) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2487290 | 0.83 | ADORA1 (0.48) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2489943 | 0.81 | ADORA1 (0.46) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2802902 | 0.81 | ADORA1 (0.44) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2489944 | 0.80 | ALDH1A1 (0.42) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL12315714 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2489846 | 0.79 | ABCB1 (0.47) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2487710 | 0.79 | LMNA (0.45) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2805078 | 0.79 | ADORA1 (0.44) | ALDH1A1MAPTLMNAHPGDALOX15 | |
| SCHEMBL2488683 | 0.79 | FAAH (0.52) | ALDH1A1MAPTLMNAHPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2379551-A1 | SUBSTITUTED PYRAZOLO [3, 4-B]PYRIDINE COMPOUNDS | ArQule, Inc. (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010078427-A1 | SUBSTITUTED PYRAZOLO [3, 4-B] PYRIDINE COMPOUNDS | ARQULE, INC. (US) | 2010-07-08 | — | — | WO | disclosed |