Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | CASP2 | P42575 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2575403 | 0.76 | HTR2A (0.62) | ALDH1A1GAARAB9AKMT2ABRD4 | |
| SCHEMBL2575269 | 0.73 | HTR2A (0.41) | ALDH1A1KDM4EGAARAB9AKMT2A | |
| SCHEMBL2572351 | 0.73 | HTR2A (0.41) | ALDH1A1KDM4EGAAKMT2ABRD4 | |
| SCHEMBL1420993 | 0.72 | ALDH1A1 (0.63) | ALDH1A1KDM4EHPGDGAANPC1 | |
| SCHEMBL27927982 | 0.69 | NR1D1 (0.47) | KDM4EHPGDLMNA | |
| SCHEMBL1184927 | 0.68 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDGAAMAPK1 | |
| SCHEMBL30377419 | 0.67 | PKM (0.46) | ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL692058 | 0.66 | HTR2C (0.41) | ALDH1A1KDM4EHPGDMAPK1SMN1; SMN2 | |
| SCHEMBL2014604 | 0.66 | HTR2C (0.51) | ALDH1A1KDM4EGAA | |
| SCHEMBL693673 | 0.66 | HTR2C (0.51) | ALDH1A1KDM4EGAA |
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-3150607-A1 | MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF | AbbVie Inc. (US) | 2017-04-05 | — | — | EP | disclosed |