Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | STK17B | O94768 | 3/20 | 0.45 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | PNLIP | P16233 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL13239956 | 0.80 | ALDH1A1 (0.58) | KDM4EALDH1A1HPGDL3MBTL1TDP1 | |
| SCHEMBL21543826 | 0.80 | KCNA3 (0.46) | KCNA3CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11099968 | 0.76 | ALDH1A1 (0.57) | KDM4EALDH1A1HPGDL3MBTL1TDP1 | |
| SCHEMBL21543711 | 0.76 | CYP1A2 (0.49) | ALDH1A1L3MBTL1TDP1STK17BKCNA3 | |
| SCHEMBL21543827 | 0.71 | CYP2A6 (0.48) | KDM4EALDH1A1HPGDTDP1STK17B | |
| SCHEMBL918577 | 0.71 | KCNA3 (0.63) | KCNA3CYP3A4MEN1KMT2APTPN1 | |
| SCHEMBL27747563 | 0.71 | CYP1A2 (0.49) | L3MBTL1TDP1KCNA3CYP1A2CYP2C19 | |
| SCHEMBL28851017 | 0.71 | KCNA3 (0.58) | KCNA3CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL20678449 | 0.71 | KCNA3 (0.71) | KCNA3CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL28498709 | 0.71 | KCNA3 (0.62) | KCNA3CYP1A2CYP2C19CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4457911-A | Dialkyl malonates as organic sunscreen adjuvants | VAN DYK & COMPANY INC. (US) | 1984-07-03 | — | — | US | disclosed |
| EP-0100651-A1 | Dialkyl malonates as organic suncreen adjuvants | VAN DYK & COMPANY, INC. (US) | 1984-02-15 | — | — | EP | disclosed |