Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18988298 | 0.90 | ADORA1 (0.48) | ALDH1A1TDP1L3MBTL1HSD17B10KDM4E | |
| SCHEMBL5090417 | 0.82 | KMT2A (0.56) | ALDH1A1TDP1HSD17B10KDM4EALOX15 | |
| SCHEMBL8915557 | 0.81 | ADORA1 (0.47) | ALDH1A1HSD17B10KDM4EADORA1ADORA2A | |
| SCHEMBL8309863 | 0.81 | GAA (0.60) | ALDH1A1TDP1HSD17B10KDM4EALOX15 | |
| SCHEMBL13664155 | 0.78 | KDM4E (0.67) | ALDH1A1HSD17B10KDM4EALOX15HTT | |
| SCHEMBL8309622 | 0.78 | MAPT (0.57) | ALDH1A1TDP1L3MBTL1KDM4EADORA1 | |
| SCHEMBL22904177 | 0.77 | MAPT (0.64) | ALDH1A1HSD17B10KDM4EALOX15HTT | |
| SCHEMBL17173942 | 0.76 | LMNA (0.56) | ALDH1A1TDP1L3MBTL1HSD17B10KDM4E | |
| SCHEMBL8914681 | 0.75 | PLAUR (0.51) | ALDH1A1L3MBTL1HSD17B10KDM4EADORA1 | |
| SCHEMBL8915716 | 0.75 | ADORA1 (0.59) | ALDH1A1KDM4EADORA1ADORA2AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5593997-A | 4-aminopyrazolo(3-,4-D)pyrimidine and 4-aminopyrazolo-(3,4-D)pyridine tyrosine kinase inhibitors | PFIZER INC. (US) | 1997-01-14 | — | — | US | disclosed |