Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20274207 | 0.79 | HDAC6 (0.49) | AKR1B1CYP2D6CYP2C9ALOX15TSHR | |
| SCHEMBL23336086 | 0.77 | FAAH (0.57) | FAAHCYP2D6CYP2C9ALOX15TSHR | |
| SCHEMBL20274152 | 0.76 | HTR2B (0.43) | DRD2CYP2D6CYP2C9ALOX15TSHR | |
| SCHEMBL20274161 | 0.71 | KCNH2 (0.52) | CYP2D6CYP2C9ALOX15TSHRCYP2C19 | |
| SCHEMBL793711 | 0.70 | CYP2A6 (0.58) | AKR1B1SLC6A2SLC6A4MEN1KMT2A | |
| SCHEMBL3637273 | 0.70 | FAAH (0.73) | FAAHAKR1B1DRD2DRD4DRD3 | |
| SCHEMBL23335850 | 0.69 | PDE7B (0.40) | CYP2D6CYP2C9ALOX15TSHRCYP2C19 | |
| SCHEMBL20274116 | 0.69 | POLB (0.54) | MAPTMEN1KMT2A | |
| SCHEMBL20274136 | 0.68 | MEN1 (0.42) | CYP2D6CYP2C9ALOX15TSHRCYP2C19 | |
| SCHEMBL15750162 | 0.68 | F2 (0.57) | MAPTNPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3428162-B1 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) | 2021-05-05 | — | — | EP | disclosed |
| EP-2922845-B1 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | MERIAL INC (US) | 2018-06-20 | — | — | EP | disclosed |