Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.63 |
| ▸ | CA12 | O43570 | 4/20 | 0.63 |
| ▸ | CA2 | P00918 | 4/20 | 0.63 |
| ▸ | CA9 | Q16790 | 4/20 | 0.63 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | CA5A | P35218 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Resorcinol SCHEMBL8945499 | 1.00 | CYP3A4 (0.63) | CYP3A4CA12CA2CA9CA14 | |
| Phenol SCHEMBL28498144 | 0.86 | TDP1 (0.61) | CYP3A4CA12CA2CA9CA14 | |
| Phloroglucinol SCHEMBL15467841 | 0.86 | TDP1 (0.56) | CYP3A4CA12CA2CA9CA14 | |
| Metacresol SCHEMBL9462901 | 0.84 | ACHE (0.71) | CYP3A4CA12CA2CA9CA14 | |
| Resorcinol SCHEMBL3094520 | 0.84 | ALDH1A1 (0.63) | CYP3A4CA12CA2CA9CA14 | |
| Phenol SCHEMBL27981066 | 0.83 | CA12 (0.65) | CYP3A4CA12CA2CA9CA14 | |
| Phenol SCHEMBL2209460 | 0.83 | CA12 (0.65) | CYP3A4CA12CA2CA9CA14 | |
| Phenol SCHEMBL27981079 | 0.83 | CA12 (0.65) | CYP3A4CA12CA2CA9CA14 | |
| Phenol SCHEMBL6908600 | 0.83 | CA12 (0.65) | CYP3A4CA12CA2CA9CA14 | |
| Resorcinol SCHEMBL19921911 | 0.83 | CA12 (0.92) | CYP3A4CA12CA2CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104974341-A | Cross-linked polyarylether polymer and preparation method thereof | UNIV JILIN | 2015-10-14 | — | — | CN | claimed |
| CN-104974341-A | Cross-linked polyarylether polymer and preparation method thereof | UNIV JILIN | 2015-10-14 | — | — | CN | disclosed |