Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | LDHB | P07195 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15313770 | 0.81 | CA1 (0.42) | CA1CA2LMNAMEN1KMT2A | |
| SCHEMBL25906339 | 0.79 | HSP90AA1 (0.60) | CA1CA2LMNASLC6A2HTR2B | |
| SCHEMBL15176931 | 0.79 | CA1 (0.71) | CA1CA2LMNASLC6A2HTR2B | |
| SCHEMBL15445309 | 0.79 | CA1 (0.71) | CA1CA2LMNASLC6A2HTR2B | |
| SCHEMBL25906337 | 0.74 | CA1 (0.57) | CA1CA2LMNASLC6A2HTR2B | |
| SCHEMBL15314338 | 0.74 | ESR1 (0.49) | LMNASLC6A2CHRM1GABRA1GABRB1 | |
| SCHEMBL25906335 | 0.73 | TRPA1 (0.48) | LMNASLC6A2HTR2BTRPA1CHRM1 | |
| SCHEMBL17281733 | 0.71 | CA1 (0.56) | CA1CA2LMNASLC6A2HTR2B | |
| SCHEMBL28000746 | 0.70 | TRPA1 (0.55) | LMNASLC6A2HTR2BTRPA1CHRM1 | |
| SCHEMBL8824342 | 0.70 | TRPA1 (0.54) | CA1CA2LMNASLC6A2HTR2B |
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-8557812-B2 | Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2013-10-15 | — | — | US | disclosed |