Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CXCR3 | P49682 | 4/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PTGIR | P43119 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL493518 | 0.88 | PTGIR (0.36) | KMT2ATHRBPTGIR | |
| SCHEMBL492721 | 0.81 | CXCR3 (0.43) | KMT2ACXCR3PTGIRALDH1A1LMNA | |
| SCHEMBL492852 | 0.80 | CXCR3 (0.46) | KMT2ACXCR3PTGIRALDH1A1LMNA | |
| SCHEMBL493517 | 0.80 | BDKRB1 (0.41) | — | |
| SCHEMBL493519 | 0.80 | LMNA (0.40) | KMT2ACXCR3THRBPTGIRALDH1A1 | |
| SCHEMBL492816 | 0.78 | BDKRB1 (0.36) | KMT2AALDH1A1 | |
| SCHEMBL493177 | 0.77 | ALDH1A1 (0.38) | KMT2ACXCR3PTGIRALDH1A1LMNA | |
| SCHEMBL492401 | 0.77 | POLB (0.40) | CXCR3ALDH1A1LMNAHTTPKM | |
| SCHEMBL493376 | 0.77 | ALDH1A1 (0.38) | KMT2ACXCR3ALDH1A1LMNAHTT | |
| SCHEMBL492871 | 0.77 | ALDH1A1 (0.38) | KMT2ACXCR3ALDH1A1LMNAHTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2139851-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2010-01-06 | — | — | EP | claimed |
| WO-2008131946-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2008-11-06 | — | — | WO | claimed |
| EP-2139851-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008131946-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2008-11-06 | — | — | WO | disclosed |