Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.67 |
| ▸ | CA1 | P00915 | 5/20 | 0.65 |
| ▸ | CA2 | P00918 | 5/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.60 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.59 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL30103322 | 1.00 | GPBAR1 (0.67) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL23704715 | 0.95 | GPBAR1 (0.66) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL23704716 | 0.95 | GPBAR1 (0.66) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL26424100 | 0.94 | GPBAR1 (0.66) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL26425786 | 0.93 | NR1H4 (0.64) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL26425773 | 0.93 | NR1H4 (0.64) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL30103315 | 0.93 | NR1H4 (0.64) | GPBAR1CA1CA2CYP3A4KMT2A | |
| SCHEMBL23710363 | 0.91 | CA1 (0.65) | GPBAR1CA1CA2KMT2AMEN1 | |
| SCHEMBL30103321 | 0.91 | CA1 (0.65) | GPBAR1CA1CA2KMT2AMEN1 | |
| SCHEMBL14457157 | 0.88 | GPBAR1 (0.84) | GPBAR1CA1CA2CYP3A4KMT2A |
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-2021155167-A1 | BILE ACID-GCPII INHIBITOR CONJUGATES TO TREAT INFLAMMATORY DISEASES | THE JOHNS HOPKINS UNIVERSITY (US) | 2021-08-05 | — | — | WO | disclosed |