Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 5/20 | 0.44 |
| ▸ | CASP3 | P42574 | 5/20 | 0.44 |
| ▸ | CASP7 | P55210 | 5/20 | 0.44 |
| ▸ | CASP6 | P55212 | 5/20 | 0.44 |
| ▸ | CASP8 | Q14790 | 5/20 | 0.44 |
| ▸ | CAPN1 | P07384 | 9/20 | 0.43 |
| ▸ | CAPNS1 | P04632 | 7/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8808445 | 0.84 | CAPN1 (0.60) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL8808465 | 0.84 | CAPN1 (0.60) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL8407723 | 0.79 | CYP1A2 (0.43) | MEN1KMT2ACASP3CAPN1CAPNS1 | |
| SCHEMBL8809095 | 0.77 | CAPN1 (0.50) | CAPN1CAPNS1TSHRALDH1A1 | |
| SCHEMBL8809572 | 0.77 | CAPN1 (0.50) | CAPN1CAPNS1 | |
| SCHEMBL8810942 | 0.77 | CAPN1 (0.44) | POLBCAPN1CAPNS1 | |
| SCHEMBL8810652 | 0.76 | CAPN1 (0.48) | CAPN1CAPNS1 | |
| SCHEMBL8808038 | 0.75 | CTSL (0.43) | KMT2ACAPN1ALDH1A1 | |
| SCHEMBL8404255 | 0.75 | HTT (0.46) | POLBCAPN1CAPNS1ALDH1A1RAB9A | |
| SCHEMBL8404287 | 0.75 | CAPN1 (0.51) | CASP1CASP3CASP7CASP6CASP8 |
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-0810221-A1 | OXYGEN-CONTAINING HETEROCYCLIC DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |