Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8904523 | 0.92 | ABCB11 (0.45) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8293709 | 0.89 | PTGS2 (0.46) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8904932 | 0.89 | MAPT (0.40) | PTGS2ABCB11ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8904955 | 0.85 | MEN1 (0.35) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL2128672 | 0.85 | ABCB11 (0.58) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8905945 | 0.80 | ABCB11 (0.44) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8905879 | 0.80 | ABCB11 (0.44) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8906007 | 0.80 | CXCL8 (0.37) | PTGS2ALDH1A1TDP1LMNACYP1A2 | |
| SCHEMBL8906084 | 0.80 | ABCB11 (0.42) | PTGS2ABCB11ALDH1A1TDP1LMNA | |
| SCHEMBL8905668 | 0.80 | ABCB11 (0.46) | PTGS2ABCB11ALDH1A1TDP1LMNA |
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-5622948-A | ANALGESICS | SYNTEX (U.S.A.) INC. (US) | 1997-04-22 | — | — | US | disclosed |
| EP-0714895-A1 | Pyrrole derivatives | F. Hoffmann-La Roche AG (CH) | 1996-06-05 | — | — | EP | disclosed |