Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 10/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.66 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.66 |
| ▸ | USP2 | O75604 | 1/20 | 0.66 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.62 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.62 |
| ▸ | SLC10A2 | Q12908 | 2/20 | 0.62 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.62 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.62 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL25705716 | 0.90 | NR3C1 (0.65) | GPBAR1CYP3A4MEN1KMT2ANR3C1 | |
| SCHEMBL25705949 | 0.90 | GPBAR1 (0.76) | GPBAR1CYP3A4MEN1KMT2ANR3C1 | |
| SCHEMBL21123848 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL21124141 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL16625469 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL16625414 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL16625470 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL21024479 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL16625410 | 0.88 | GPBAR1 (0.73) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 | |
| SCHEMBL24170380 | 0.88 | GPBAR1 (1.00) | GPBAR1CYP3A4MEN1KMT2ASLCO1B3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021188480-A1 | IMMUNOMODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-09-23 | — | — | WO | disclosed |