Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320550 | 0.75 | NPC1 (0.57) | MAPTALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL29090390 | 0.74 | NOTUM (0.40) | PTGESMAPTMEN1LMNAKMT2A | |
| SCHEMBL23320407 | 0.71 | FBP1 (0.38) | MAPTMEN1LMNAKMT2AHTT | |
| SCHEMBL17441671 | 0.70 | MAPT (0.45) | MAPTALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL16112325 | 0.68 | ALDH1A1 (0.45) | AADATMAPTALDH1A1MEN1LMNA | |
| SCHEMBL21484056 | 0.68 | NOTUM (0.37) | MAPTALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL26529726 | 0.67 | MAPT (0.41) | PTGESMAPTALDH1A1MEN1LMNA | |
| SCHEMBL29969276 | 0.67 | MAPT (0.44) | MAPTALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL17440801 | 0.67 | IRAK4 (0.39) | MAPTMEN1LMNAKMT2ACYP1A2 | |
| SCHEMBL29968961 | 0.67 | MAPT (0.42) | MAPTALDH1A1MEN1LMNAKMT2A |
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-2020021024-A1 | SUBSTITUTED BICYCLIC COMPOUNDS AS MODULATORS OF THE ARYL HYDROCARBON RECEPTOR (AHR) | PHENEX PHARMACEUTICALS AG (DE) | 2020-01-30 | — | — | WO | disclosed |