Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 8/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.39 |
| ▸ | GLRB | P48167 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28114687 | 0.89 | VCAM1 (0.47) | VCAM1PTGS1GAACA1CA2 | |
| SCHEMBL28049859 | 0.87 | VCAM1 (0.47) | VCAM1PTGS1GAACA1CA2 | |
| SCHEMBL1278397 | 0.82 | LMNA (0.44) | GAACA1CA2ALDH1A1TDP1 | |
| SCHEMBL27475122 | 0.81 | VCAM1 (0.45) | VCAM1PTGS1GAACA1CA2 | |
| SCHEMBL1278249 | 0.79 | LMNA (0.46) | PTGS1GAACA1CA2ALDH1A1 | |
| SCHEMBL11782511 | 0.78 | VCAM1 (0.45) | VCAM1PTGS1GAACA1CA2 | |
| SCHEMBL11778178 | 0.77 | ALDH1A1 (0.45) | VCAM1GAACA1CA2ALDH1A1 | |
| SCHEMBL2542322 | 0.77 | GPR84 (0.40) | GAACA1CA2ALDH1A1TDP1 | |
| SCHEMBL11728968 | 0.77 | GPR84 (0.40) | GAACA1CA2ALDH1A1TDP1 | |
| SCHEMBL39475 | 0.77 | GPR84 (0.40) | GAACA1CA2ALDH1A1TDP1 |
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-104817435-A | Method for preparing 2, 6-di-tert-butylphenol from recovered waste | YINGKOU FENGGUANG CHEMICAL CO LTD | 2015-08-05 | — | — | CN | disclosed |