Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8505516 | 0.94 | CYP2C9 (0.50) | CYP2C9CYP2C19NPSR1LMNATSHR | |
| Benzenesulfonamide SCHEMBL8526038 | 0.84 | PTGES2 (0.48) | CA12CA1CA2CA9 | |
| SCHEMBL8502466 | 0.84 | CYP2C9 (0.53) | CA12CA1CA2CA9CYP2C9 | |
| Benzenesulfonamide SCHEMBL8526101 | 0.83 | POLB (0.51) | CA12CA1CA2CA9CYP2C9 | |
| Benzenesulfonamide SCHEMBL8526469 | 0.83 | CA1 (0.47) | CA12CA1CA2CA9HSD17B10 | |
| SCHEMBL8504989 | 0.80 | CYP2C9 (0.53) | CA12CA1CA2CA9CYP2C9 | |
| Benzenesulfonamide SCHEMBL8525288 | 0.79 | CA12 (0.48) | CA12CA1CA2CA9CYP2C9 | |
| SCHEMBL8502313 | 0.78 | ALDH1A1 (0.49) | CYP2C9CYP2C19LMNAPOLBCYP3A4 | |
| SCHEMBL8504469 | 0.78 | TSHR (0.48) | CYP2C9TSHRALDH1A1KMT2AMEN1 | |
| SCHEMBL8506063 | 0.78 | CYP2C9 (0.51) | CYP2C9CYP2C19HSD17B10ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0946507-A1 | SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998025896-A1 | SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1998-06-18 | — | — | WO | disclosed |