Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.59 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 13/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29396259 | 0.99 | CYP11B1 (0.57) | CYP11B1CYP11B2PTGS2PTGS1CA1 | |
| SCHEMBL29400487 | 0.89 | CA1 (0.61) | CYP11B1CYP11B2PTGS2PTGS1CA1 | |
| Hydrochloric Acid SCHEMBL29398543 | 0.88 | CA1 (0.60) | CYP11B1CYP11B2PTGS2PTGS1CA1 | |
| SCHEMBL17212254 | 0.81 | ACSS2 (0.64) | CYP11B1CYP11B2PTGS2CA1CA2 | |
| SCHEMBL29396714 | 0.80 | CA1 (0.76) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL13495669 | 0.78 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL30425393 | 0.78 | CA1 (0.64) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL25365631 | 0.76 | CA1 (0.49) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL31578554 | 0.76 | CA1 (0.49) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL10424045 | 0.75 | ALDH1A1 (0.58) | CYP11B1CYP11B2CA1CA2CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116075510-A | 1H-benzo [ d ] imidazole derivatives as TLR9 inhibitors for the treatment of fibrosis | 百时美施贵宝公司 | 2023-05-05 | — | — | CN | claimed |
| CN-116075510-A | 1H-benzo [ d ] imidazole derivatives as TLR9 inhibitors for the treatment of fibrosis | 百时美施贵宝公司 | 2023-05-05 | — | — | CN | disclosed |