Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL113374 | 0.82 | TYK2 (0.40) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL167315 | 0.81 | MAPT (0.45) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL157316 | 0.81 | HPGD (0.43) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL163614 | 0.80 | NPC1 (0.42) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL13097268 | 0.70 | TYK2 (0.40) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL112720 | 0.66 | TRPV1 (0.42) | MAPTSMN1; SMN2LMNAHTTALDH1A1 | |
| SCHEMBL111377 | 0.66 | CXCR3 (0.46) | MAPTSMN1; SMN2GAALMNAHTT | |
| SCHEMBL112787 | 0.66 | TYK2 (0.43) | MAPTSMN1; SMN2GAATSHRLMNA | |
| SCHEMBL3105119 | 0.64 | TRPV1 (0.50) | KDM4ESMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL114399 | 0.63 | ALDH1A1 (0.43) | MAPTKDM4EHPGDHSD17B10SMN1; SMN2 |
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-2424858-A1 | CXCR3 RECEPTOR ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-03-07 | — | — | EP | disclosed |