Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 15/20 | 0.48 |
| ▸ | BCR | P11274 | 15/20 | 0.48 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.46 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL18696393 | 0.87 | ABL1 (0.53) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL3402884 | 0.85 | ABL1 (0.51) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL17487035 | 0.84 | ABL1 (0.50) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL12943130 | 0.84 | ABL1 (0.57) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL3401859 | 0.83 | ABL1 (0.52) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL3397117 | 0.83 | DHODH (0.50) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL18696394 | 0.83 | ABL1 (0.47) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL3397912 | 0.83 | ABL1 (0.61) | ABL1BCRTTBK1TTBK2 | |
| SCHEMBL18696249 | 0.82 | ABL1 (0.48) | ABL1BCRTTBK1TTBK2DHODH | |
| SCHEMBL18696183 | 0.82 | ABL1 (0.51) | ABL1BCRTTBK1TTBK2 |
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-3536687-B1 | SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE | DANA FARBER CANCER INST INC (US) | 2021-07-14 | — | — | EP | disclosed |