Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7536743 | 1.00 | HRH4 (0.41) | HRH4TAAR1CYP3A4CYP2D6TSHR | |
| SCHEMBL7539925 | 0.82 | NPC1 (0.52) | TAAR1CYP3A4CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL7539929 | 0.82 | NPC1 (0.52) | TAAR1CYP3A4CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL7430228 | 0.76 | BCHE (0.44) | CYP2D6LMNA | |
| SCHEMBL7436937 | 0.76 | MME (0.41) | TACR1 | |
| SCHEMBL7536738 | 0.74 | MMP1 (0.42) | HRH4 | |
| SCHEMBL7305187 | 0.74 | REN (0.45) | TAAR1LMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL7280361 | 0.73 | NPC1 (0.53) | TAAR1CYP3A4CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL7322799 | 0.73 | NPC1 (0.53) | TAAR1CYP3A4CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL7302265 | 0.72 | ANPEP (0.49) | CYP3A4CYP2D6TACR1LTB4RLTB4R2 |
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-0416393-A1 | Peptidyl difluorodiol renin inhibitors | ABBOTT LABORATORIES (US) | 1991-03-13 | — | — | EP | disclosed |