Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HTR1D | P28221 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CCR3 | P51677 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20083978 | 0.93 | ACKR3 (0.43) | ACKR3HTR1AHTR1DHTR1BNPC1 | |
| SCHEMBL19156951 | 0.90 | NPC1 (0.52) | ACKR3HTR1AHTR1DHTR1BNPC1 | |
| SCHEMBL19157145 | 0.88 | POLB (0.42) | ACKR3HTR1AHTR1DHTR1BRAB9A | |
| SCHEMBL21844944 | 0.88 | HTR1A (0.54) | ACKR3HTR1AHTR1DHTR1BNPC1 | |
| SCHEMBL20083992 | 0.87 | POLB (0.43) | ACKR3HTR1AHTR1DHTR1BRAB9A | |
| SCHEMBL20083976 | 0.87 | ACKR3 (0.49) | ACKR3HTR1AHTR1DHTR1BROCK2 | |
| SCHEMBL19157071 | 0.84 | ROCK2 (0.49) | ACKR3HTR1AROCK2 | |
| SCHEMBL21844837 | 0.81 | HTR2A (0.47) | ACKR3HTR1AHTR1DHTR1BNPC1 | |
| SCHEMBL19157407 | 0.80 | HTR1A (0.56) | ACKR3HTR1AHTR1DHTR1BNPC1 | |
| SCHEMBL20083956 | 0.79 | MCHR1 (0.53) | TP53MAPT |
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 |