Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.44 |
| ▸ | CA2 | P00918 | 6/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1851394 | 0.78 | BCHE (0.52) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL28198886 | 0.77 | BCHE (0.50) | CA1CA2MMP1MMP2MMP9 | |
| Dibenzyl Disulfide SCHEMBL16332737 | 0.74 | HSD17B10 (0.52) | CA1CA2CYP2C19IDO1NOS3 | |
| Dibenzyl Disulfide SCHEMBL160895 | 0.74 | HSD17B10 (0.52) | CA1CA2CYP2C19IDO1NOS3 | |
| Thiosulfuric Acid SCHEMBL27471984 | 0.72 | CYP2C19 (0.52) | CA1CA2CYP2C19IDO1NOS3 | |
| Thiosulfuric Acid SCHEMBL27471985 | 0.72 | CYP2C19 (0.52) | CA1CA2CYP2C19IDO1NOS3 | |
| Dibenzyl Disulfide SCHEMBL27512197 | 0.72 | IDO1 (0.50) | CA1CA2CYP2C19IDO1NOS3 | |
| Dibenzyl Disulfide SCHEMBL31120434 | 0.71 | HSD17B10 (0.50) | CA1CA2CYP2C19IDO1NOS3 | |
| Dibenzyl Disulfide SCHEMBL5313009 | 0.71 | ALDH1A1 (0.50) | CA1CA2CYP2C19IDO1NOS3 | |
| Dibenzyl Disulfide SCHEMBL32679343 | 0.71 | HSD17B10 (0.50) | CA1CA2CYP2C19IDO1NOS3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102017016-A | Connecting material and semiconductor device | HITACHI CHEMICAL CO LTD | 2011-04-13 | — | — | CN | disclosed |