Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MMP8 | P22894 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CCR6 | P51684 | 1/20 | 0.44 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.44 |
| ▸ | CBFB | Q13951 | 1/20 | 0.44 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL7044583 | 0.85 | PIN1 (0.53) | PIN1NPC1MEN1KMT2AMMP8 | |
| Benzene SCHEMBL28153331 | 0.84 | PIN1 (0.48) | PIN1NPC1MEN1KMT2AMMP8 | |
| Chlorobenzene SCHEMBL11711196 | 0.84 | MEN1 (0.56) | PIN1NPC1MEN1KMT2AMMP8 | |
| Phenol SCHEMBL5006868 | 0.83 | PIN1 (0.51) | PIN1NPC1MEN1KMT2AMMP8 | |
| Benzene SCHEMBL27512416 | 0.82 | PIN1 (0.47) | PIN1NPC1MEN1KMT2AMMP8 | |
| Phenol SCHEMBL28225163 | 0.81 | PIN1 (0.50) | PIN1NPC1MEN1KMT2AMMP8 | |
| Chlorobenzene SCHEMBL16616568 | 0.81 | ALDH1A1 (0.56) | PIN1NPC1MEN1KMT2ATSHR | |
| Chlorobenzene SCHEMBL15562499 | 0.81 | ALDH1A1 (0.56) | PIN1NPC1MEN1KMT2ATSHR | |
| Chlorobenzene SCHEMBL18834102 | 0.81 | ALDH1A1 (0.56) | PIN1NPC1MEN1KMT2ATSHR | |
| Ethyl Propionate SCHEMBL27547003 | 0.79 | MEN1 (0.49) | PIN1MEN1KMT2ATSHRLMNA |
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-1044458-A | Produce PTS \" anticancer spirit \" processing method | NANCHANG GROUND FORCE COLLEGE (CN) | 1990-08-08 | — | — | CN | disclosed |