Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | C3AR1 | Q16581 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12492378 | 0.89 | CTSK (0.37) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL12492379 | 0.89 | CTSK (0.37) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL12455889 | 0.72 | HDAC1 (0.39) | KMT2ACA1CA2MAPTGAA | |
| SCHEMBL17281398 | 0.70 | DAGLA (0.36) | KDM4EALDH1A1 | |
| SCHEMBL12682253 | 0.70 | DAGLA (0.35) | MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15214453 | 0.68 | C3AR1 (0.43) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL800492 | 0.68 | KMT2A (0.49) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL15214452 | 0.68 | C3AR1 (0.40) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL800494 | 0.68 | KMT2A (0.48) | KMT2ATRPA1TSHRHSD17B10C3AR1 | |
| SCHEMBL3511397 | 0.68 | KMT2A (0.48) | KMT2ATRPA1TSHRHSD17B10C3AR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2685982-B1 | PYRROLOPYRIDAZINE JAK3 INHIBITORS AND THEIR USE FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES | BRISTOL MYERS SQUIBB CO (US) | 2017-07-05 | — | — | EP | disclosed |