Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCL12 | P48061 | 5/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 5/20 | 0.47 |
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL363641 | 0.81 | CXCL12 (0.59) | CXCL12PTGS1PTGS2MAOBMAOA | |
| SCHEMBL19782926 | 0.76 | CXCL12 (1.00) | CXCL12PTGS1PTGS2MAOBMAOA | |
| SCHEMBL25196746 | 0.76 | CXCL12 (0.81) | CXCL12PTGS1PTGS2MAOBABCG2 | |
| SCHEMBL25245508 | 0.76 | CXCL12 (0.81) | CXCL12PTGS1PTGS2MAOBABCG2 | |
| SCHEMBL14692575 | 0.76 | MAOB (0.72) | CXCL12PTGS1PTGS2MAOBMAOA | |
| SCHEMBL9420986 | 0.76 | MAOB (0.72) | CXCL12PTGS1PTGS2MAOBMAOA | |
| SCHEMBL9106499 | 0.76 | TTR (0.54) | MAPTALDH1A1LMNACYP2C9CYP2C19 | |
| SCHEMBL9106504 | 0.76 | TTR (0.54) | MAPTALDH1A1LMNACYP2C9CYP2C19 | |
| SCHEMBL30504728 | 0.75 | ABCG2 (0.83) | CXCL12PTGS1PTGS2MAOBMAOA | |
| SCHEMBL31448615 | 0.74 | PTGS1 (0.73) | CXCL12PTGS1PTGS2MAOBMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015187934-A1 | FUNCTIONALIZED HETROARYL ENONES EXHIBITING NRF2 ACTIVATION AND THEIR METHOD OF USE | CUREVEDA, LLC (US) | 2015-12-10 | — | — | WO | disclosed |