Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7678562 | 0.89 | PTGS2 (0.57) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL9030622 | 0.86 | PTGS2 (0.74) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8605749 | 0.86 | ABCB11 (0.59) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7681228 | 0.86 | PTGS2 (0.74) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL10881034 | 0.83 | PTGS2 (0.53) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7675690 | 0.78 | PTGS2 (0.73) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL10879085 | 0.77 | PTGS2 (0.55) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL11810708 | 0.76 | PTGS2 (0.55) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7682901 | 0.76 | PTGS2 (0.44) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL11713094 | 0.76 | PTGS2 (0.56) | PTGS2ABCB11SMN1; SMN2ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4255335-A | Preparation of 5-aroyl-1-loweralkylpyrrole-2-acetic acid derivatives | MCNEILAB, INC. (US) | 1981-03-10 | — | — | US | disclosed |