Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 5/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.52 |
| ▸ | TAS2R14 | Q9NYV8 | 7/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.50 |
| ▸ | MMP7 | P09237 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | MMP12 | P39900 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | PTGES | O14684 | 1/20 | 0.49 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.49 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.49 |
| ▸ | F2 | P00734 | 1/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.49 |
| ▸ | BMP1 | P13497 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6462705 | 0.91 | KEAP1 (0.48) | KEAP1NFE2L2TAS2R14MMP1MMP7 | |
| SCHEMBL5931099 | 0.81 | ALDH1A1 (0.51) | KEAP1NFE2L2TAS2R14F2PRSS1 | |
| SCHEMBL6470502 | 0.81 | OPRK1 (0.42) | KEAP1NFE2L2MMP1MMP7MMP8 | |
| SCHEMBL6465700 | 0.79 | KEAP1 (0.50) | KEAP1NFE2L2TAS2R14MMP1MMP8 | |
| SCHEMBL6470238 | 0.75 | ALDH1A1 (0.45) | KEAP1NFE2L2TAS2R14 | |
| SCHEMBL8620628 | 0.74 | TP53 (0.55) | KEAP1NFE2L2TAS2R14F2 | |
| SCHEMBL4936946 | 0.73 | SMN1; SMN2 (0.77) | KEAP1NFE2L2TAS2R14MMP1MMP7 | |
| SCHEMBL10493406 | 0.73 | CA12 (0.51) | — | |
| SCHEMBL9478142 | 0.73 | TP53 (0.73) | KEAP1NFE2L2 | |
| SCHEMBL6465065 | 0.73 | TP53 (0.54) | KEAP1NFE2L2F2PKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050255998-A1 | Mixture of colour developers | CIBA SPECIALTY CHEMICALS CORP. | 2005-11-17 | — | — | US | disclosed |
| US-20050106491-A1 | Heat sensitive recording material | CIBA SPECIALTY CHEMICALS CORP. | 2005-05-19 | — | — | US | disclosed |
| US-5612280-A | AROMATIC SULFONYLUREA AND SULFONYLTHIOUREA DERIVATIVES AS COLOR DEVELOPERS; COLORFASTNESS, STORAGE STABILITY, WHITENESS | NEW OJI PAPER CO., LTD. (JP) | 1997-03-18 | — | — | US | disclosed |