Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 14/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | HTR3A | P46098 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2330306 | 0.83 | HTR4 (0.49) | HTR4ACHENPC1RAB9AKMT2A | |
| SCHEMBL12630140 | 0.81 | HTR4 (0.52) | HTR4ACHEHTR3ACYP3A4CYP2D6 | |
| SCHEMBL2012321 | 0.72 | HTR4 (0.51) | HTR4HTR3ACYP3A4CYP2D6 | |
| SCHEMBL2009661 | 0.72 | HTR4 (0.65) | HTR4HTR3ACYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL2009599 | 0.72 | HTR4 (0.64) | HTR4HTR3A | |
| SCHEMBL6328190 | 0.69 | HTR4 (0.54) | HTR4ACHENPC1RAB9AKMT2A | |
| SCHEMBL7259744 | 0.69 | HTR4 (0.51) | HTR4ACHENPC1RAB9AKMT2A | |
| SCHEMBL2337922 | 0.69 | HTR4 (0.51) | HTR4 | |
| SCHEMBL17709625 | 0.66 | HTR4 (1.00) | HTR4ACHE | |
| SCHEMBL5759188 | 0.66 | ELANE (0.60) | NPC1RAB9ACYP3A4 |
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-1713797-A1 | 1-ISOPROPYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE DERIVATIVES HAVING 5-HT sb 4 /sb RECEPTOR AGONISTIC ACTIVITY | Pfizer, Inc. (US) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005073222-A1 | 1-ISOPROPYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE DERIVATIVES HAVING 5-HT4 RECEPTOR AGONISTIC ACTIVITY | PFIZER JAPAN, INC. (JP) | 2005-08-11 | — | — | WO | disclosed |