Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.54 |
| ▸ | HTR1D | P28221 | 3/20 | 0.54 |
| ▸ | HTR1B | P28222 | 3/20 | 0.54 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | UBE2M | P61081 | 1/20 | 0.47 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21844837 | 0.93 | HTR2A (0.47) | HTR1AHTR1DHTR1BACKR3NPC1 | |
| SCHEMBL19156951 | 0.89 | NPC1 (0.52) | HTR1AHTR1DHTR1BACKR3NPC1 | |
| SCHEMBL21844832 | 0.88 | ACKR3 (0.50) | HTR1AHTR1DHTR1BACKR3NPC1 | |
| SCHEMBL21844945 | 0.87 | ACKR3 (0.53) | ACKR3NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL21844943 | 0.87 | ALDH1A1 (0.54) | HTR1AHTR1DHTR1BACKR3RAB9A | |
| SCHEMBL19157407 | 0.86 | HTR1A (0.56) | HTR1AHTR1DHTR1BACKR3NPC1 | |
| SCHEMBL21844836 | 0.86 | ACKR3 (0.51) | HTR1AHTR1DHTR1BACKR3KMT2A | |
| SCHEMBL20083898 | 0.85 | KDR (0.44) | HTR1AHTR1DHTR1BACKR3KMT2A | |
| SCHEMBL21844835 | 0.83 | ROCK2 (0.54) | HTR1AHTR1DHTR1BACKR3HTR2A | |
| SCHEMBL20083978 | 0.81 | ACKR3 (0.43) | HTR1AHTR1DHTR1BACKR3NPC1 |
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-3312160-B1 | HEPATITIS B ANTIVIRAL AGENTS | NOVIRA THERAPEUTICS INC (US) | 2020-03-18 | — | — | EP | disclosed |