Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GSK3A | P49840 | 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 | |
|---|---|---|---|---|
| SCHEMBL9371007 | 0.91 | KMT2A (0.49) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9367530 | 0.91 | TSHR (0.51) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9373872 | 0.89 | CYP2C9 (0.46) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9367118 | 0.89 | TSHR (0.46) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9369978 | 0.89 | MDM4 (0.52) | TSHRKMT2AKDM4EMEN1HTT | |
| SCHEMBL9373932 | 0.87 | MDM4 (0.51) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9370377 | 0.87 | CYP2C9 (0.44) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9370626 | 0.87 | KMT2A (0.53) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9375456 | 0.86 | KMT2A (0.44) | TSHRCYP2C9KMT2ARECQLKDM4E | |
| SCHEMBL9375173 | 0.85 | PTGS2 (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-62181204-A | — | — | None | — | — | JP | disclosed |
| JP-S62181204-A | NONMEDICAL GERMICIDE | KUMIAI CHEM IND CO LTD | 1987-08-08 | — | — | JP | disclosed |