Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | PPOX | P50336 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | MERTK | Q12866 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12789525 | 0.85 | HSPB1 (0.51) | HSPB1TDP1SMN1; SMN2CRHBPCRHR2 | |
| SCHEMBL16123041 | 0.84 | TDP1 (0.51) | TDP1SMN1; SMN2MEN1TTRKMT2A | |
| SCHEMBL3890179 | 0.83 | TDP1 (0.56) | HSPB1TDP1CRHBPCRHR2MEN1 | |
| SCHEMBL2424186 | 0.83 | TDP1 (0.61) | HSPB1TDP1SMN1; SMN2CRHBPCRHR2 | |
| SCHEMBL22065496 | 0.82 | ALDH1A1 (0.49) | TDP1SMN1; SMN2LMNAMAPTMERTK | |
| SCHEMBL13715272 | 0.82 | SMN1; SMN2 (0.44) | HSPB1TDP1SMN1; SMN2CRHBPCRHR2 | |
| SCHEMBL12846984 | 0.81 | TDP1 (0.47) | HSPB1TDP1SMN1; SMN2CRHBPCRHR2 | |
| SCHEMBL22064872 | 0.80 | ALDH1A1 (0.40) | TDP1SMN1; SMN2MEN1TTRPPOX | |
| SCHEMBL13743629 | 0.79 | NPSR1 (0.43) | HSPB1TDP1SMN1; SMN2MEN1TTR | |
| SCHEMBL13715181 | 0.78 | MEN1 (0.43) | HSPB1TDP1SMN1; SMN2MEN1KMT2A |
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-2297117-B1 | BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS | MERCK SHARP & DOHME (US) | 2012-10-31 | — | — | EP | disclosed |