Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 3/20 | 0.39 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.34 |
| ▸ | ITGAL | P20701 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CRHBP | P24387 | 2/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8509034 | 0.98 | CYP2B6 (0.40) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL3434973 | 0.98 | CYP2B6 (0.40) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL28641591 | 0.96 | CYP2B6 (0.39) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL29012356 | 0.96 | CYP2B6 (0.39) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL27950725 | 0.96 | CYP2B6 (0.39) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL11367023 | 0.96 | CYP2B6 (0.41) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL11367029 | 0.96 | CYP2B6 (0.41) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL130348 | 0.96 | CYP2B6 (0.41) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL322176 | 0.96 | CYP2B6 (0.41) | CYP2B6STSABCG2ITGB2ICAM1 | |
| SCHEMBL2053746 | 0.96 | CYP2B6 (0.41) | CYP2B6STSABCG2ITGB2ICAM1 |
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-5120496-A | STAINLESS WROUGHT AND CAST MATERIALS AND WELDING ADDITIVES FOR STRUCTURAL UNITS EXPOSED TO HOT, CONCENTRATED SULFURIC ACID | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-09 | — | — | US | disclosed |
| US-5051233-A | Acid resistance in iron, chrome, nickel and silicon alloy | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-24 | — | — | US | disclosed |