Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL776644 | 0.78 | TSHR (0.70) | CYP3A4TSHRMEN1KMT2AHPGD | |
| SCHEMBL7207078 | 0.76 | SRC (0.60) | CYP3A4TSHRCYP2C19SMN1; SMN2MEN1 | |
| SCHEMBL11177722 | 0.76 | MEN1 (0.61) | CYP3A4TSHRCYP2C19SMN1; SMN2MEN1 | |
| SCHEMBL4140665 | 0.76 | HPGD (0.55) | CYP3A4TSHRCYP2C19SMN1; SMN2MEN1 | |
| SCHEMBL13056457 | 0.76 | TDP1 (0.48) | CYP3A4TSHRCYP2C19SMN1; SMN2MEN1 | |
| SCHEMBL310184 | 0.75 | SRC (0.58) | MEN1KMT2AHPGDSRCLMNA | |
| SCHEMBL28572424 | 0.74 | SRC (0.37) | CYP2C19HPGDSRCLMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL29186320 | 0.73 | SRC (0.56) | MEN1KMT2AHPGDSRCLMNA | |
| SCHEMBL778838 | 0.73 | SMN1; SMN2 (0.69) | CYP3A4TSHRCYP2C19SMN1; SMN2BLM | |
| SCHEMBL28563050 | 0.73 | CYP2C19 (0.40) | CYP3A4TSHRCYP2C19SMN1; SMN2MEN1 |
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-112930345-A | Novel halo- (3- (phenylsulfonyl) prop-1-ene) pyridine derivatives and uses thereof | 韩国科学技术研究院 | 2021-06-08 | — | — | CN | disclosed |