Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 3/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL11808824 | 0.79 | PTGS2 (0.52) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL9507211 | 0.78 | PTGS2 (0.56) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL4464522 | 0.77 | ACHE (0.45) | PTGS2TAAR1ACHETUBB1CYP3A4 | |
| SCHEMBL18480805 | 0.77 | PTGS2 (0.50) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL18480665 | 0.73 | CA1 (0.50) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL3392217 | 0.73 | HSP90AA1 (0.45) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL3393633 | 0.72 | CA2 (0.49) | PTGS2CA1CA2CA4CA6 | |
| SCHEMBL3392800 | 0.72 | HSP90AA1 (0.44) | PTGS2CA1CA2CA4CA6 | |
| SCHEMBL7048608 | 0.70 | PTGS2 (0.47) | PTGS2TAAR1CA1CA2CA4 | |
| SCHEMBL13402722 | 0.70 | PTGS2 (0.47) | PTGS2CA1CA2CA4CA6 |
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-6743303-B2 | CONTACTING METAL SURFACE WITH ADHESION PROMOTION FORMULATION COMPRISING SULFURIC ACID AND PHOSPHORIC ACID TO FORM A MICRO-ROUGHENED CONVERSION COATED METAL SURFACE, CONTACTING WITH AQUEOUS ORGANOSILICON FORMULATION | SHIPLEY COMPANY, L.L.C. | 2004-06-01 | — | — | US | disclosed |
| US-20020132056-A1 | Contacting metal surface with adhesion promotion formulation comprising sulfuric acid and phosphoric acid to form a micro-roughened conversion coated metal surface, contacting with aqueous organosilicon formulation | SHIPLEY COMPANY, L.L.C. (US) | 2002-09-19 | — | — | US | disclosed |