Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL627005 | 0.86 | S1PR4 (0.46) | S1PR4HTR3ACYP2A6HRH3KDM4E | |
| SCHEMBL3597858 | 0.81 | TDP1 (0.48) | S1PR4HTR3AHRH4BACE1CYP2A6 | |
| SCHEMBL27787626 | 0.78 | S1PR4 (0.40) | S1PR4HRH3MEN1KMT2ALMNA | |
| SCHEMBL14912329 | 0.78 | KDM4E (0.45) | HTR3AHRH4BACE1CYP2A6KDM4E | |
| SCHEMBL14912331 | 0.78 | KDM4E (0.45) | HTR3AHRH4BACE1CYP2A6KDM4E | |
| SCHEMBL31505363 | 0.77 | ESR2 (0.50) | KDM4EMEN1KMT2ATDP1NPC1 | |
| SCHEMBL27787595 | 0.77 | BACE1 (0.53) | BACE1CYP2A6KDM4EMEN1KMT2A | |
| SCHEMBL29037571 | 0.77 | CYP1A2 (0.57) | BACE1CYP2A6KDM4EMEN1KMT2A | |
| SCHEMBL5110732 | 0.77 | RAB9A (0.59) | HTR3AHRH4BACE1KDM4EMEN1 | |
| SCHEMBL6711817 | 0.77 | RAB9A (0.59) | HTR3AHRH4BACE1KDM4EMEN1 |
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-101591291-A | The synthetic method of 2-ethenyl quinoline compound | INST MATERIA MEDICA CAMS (CN) | 2009-12-02 | — | — | CN | claimed |
| CN-101591291-A | The synthetic method of 2-ethenyl quinoline compound | INST MATERIA MEDICA CAMS (CN) | 2009-12-02 | — | — | CN | disclosed |
| US-4172180-A | BASIC POLYMER WHICH REACTS WITH HYDROGEN HALIDE AND IS CAPABLE OF FORMING QUATERNARY SALT, AND HALOGEN CONTAINING POLYMER CAPABLE OF FORMING CONJUGATED POLYENE BY ELIMINATION OF HYDROGEN HALIDE | FUJI PHOTO FILM CO., LTD. (JP) | 1979-10-23 | — | — | US | disclosed |