Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.68 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11713188 | 0.88 | ABCB11 (0.52) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| SCHEMBL11720309 | 0.86 | CYP1A2 (0.50) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| SCHEMBL11494142 | 0.84 | ALDH1A1 (0.48) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| Zomepirac SCHEMBL9655800 | 0.83 | PTGS2 (0.97) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| SCHEMBL11495897 | 0.83 | ALDH1A1 (0.47) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| Zomepirac SCHEMBL7204056 | 0.82 | PTGS2 (0.95) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| SCHEMBL11488302 | 0.82 | ALDH1A1 (0.45) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| Zomepirac SCHEMBL11495798 | 0.81 | PTGS2 (1.00) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| Zomepirac SCHEMBL25735 | 0.81 | PTGS2 (1.00) | ABCB11PTGS2CYP1A2LMNAALDH1A1 | |
| SCHEMBL10905829 | 0.81 | PTGS2 (0.80) | ABCB11PTGS2CYP1A2LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4213905-A | Preparation of 5-aroyl-1-loweralkylpyrrole-2-acetic acid salts | MCNEILAB, INC. (US) | 1980-07-22 | — | — | US | claimed |
| US-4213905-A | Preparation of 5-aroyl-1-loweralkylpyrrole-2-acetic acid salts | MCNEILAB, INC. (US) | 1980-07-22 | — | — | US | disclosed |