Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 11/20 | 0.44 |
| ▸ | CA1 | P00915 | 10/20 | 0.44 |
| ▸ | CA12 | O43570 | 6/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 8/20 | 0.41 |
| ▸ | CA5A | P35218 | 3/20 | 0.41 |
| ▸ | CA4 | P22748 | 3/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7058245 | 0.88 | CA2 (0.48) | CA2CA1CA12CA14LMNA | |
| SCHEMBL1808150 | 0.88 | CA2 (0.43) | CA2CA1CA12CA14LMNA | |
| SCHEMBL1808152 | 0.86 | CDK2 (0.43) | CA2CA1CA12CA14LMNA | |
| SCHEMBL29469903 | 0.85 | CA2 (0.46) | CA2CA1CA12CA14LMNA | |
| SCHEMBL4617735 | 0.85 | CA2 (0.46) | CA2CA1CA12CA14LMNA | |
| SCHEMBL1806547 | 0.85 | CA2 (0.51) | CA2CA1CA12CA14LMNA | |
| SCHEMBL1806548 | 0.83 | CA1 (0.47) | CA2CA1CA12CA14LMNA | |
| SCHEMBL12393348 | 0.82 | TAAR1 (0.41) | — | |
| SCHEMBL12393347 | 0.82 | TAAR1 (0.41) | — | |
| SCHEMBL18700968 | 0.82 | GABRA1 (0.41) | CA2CA1CA12CA14LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029076-B | Benzo piperazine composition as BET bromine domain inhibitor | 福马疗法公司 | 2019-06-07 | — | — | CN | disclosed |