Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | SRC | P12931 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 6/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL218003 | 0.96 | CYP3A4 (0.57) | TSHRCYP3A4SRCMEN1KMT2A | |
| Toluene SCHEMBL26607511 | 0.94 | SRC (0.59) | TSHRCYP3A4SRCMEN1KMT2A | |
| P-Xylene SCHEMBL8467418 | 0.94 | SRC (0.59) | TSHRCYP3A4SRCMEN1KMT2A | |
| Biphenyl SCHEMBL17782089 | 0.92 | CYP3A4 (0.53) | TSHRCYP3A4SRCMEN1KMT2A | |
| Toluene SCHEMBL29116599 | 0.92 | SRC (0.57) | TSHRCYP3A4SRCMEN1KMT2A | |
| SCHEMBL157866 | 0.92 | TSHR (0.67) | TSHRCYP3A4SRCMEN1KMT2A | |
| Toluene SCHEMBL29178514 | 0.90 | SRC (0.55) | TSHRCYP3A4SRCMEN1KMT2A | |
| Naphthalene SCHEMBL15952534 | 0.90 | CYP3A4 (0.55) | TSHRCYP3A4SRCMEN1KMT2A | |
| SCHEMBL5597386 | 0.90 | TSHR (0.55) | TSHRCYP3A4SRCMEN1KMT2A | |
| Fluoride SCHEMBL31047203 | 0.90 | TSHR (0.64) | TSHRCYP3A4SRCMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111761772-A | Preparation method of high-flame-retardant smoke-suppression LVT floor wear-resistant layer | 宜宾天亿新材料科技有限公司 | 2020-10-13 | — | — | CN | claimed |
| CN-113603984-A | Non-foaming flame-retardant anti-fogging PVC leather and preparation method and application thereof | 广东天进新材料有限公司 | 2021-11-05 | — | — | CN | disclosed |
| CN-111423799-A | Water-based polyurea coating material and preparation method thereof | 沈阳化工研究院有限公司 | 2020-07-17 | — | — | CN | disclosed |