Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | NSD1 | Q96L73 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL24987313 | 0.85 | CYP2C19 (0.60) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL2911344 | 0.83 | NSD1 (0.49) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL26962466 | 0.83 | HSD17B10 (0.60) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL23196210 | 0.83 | ALDH1A1 (0.51) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL10432129 | 0.83 | CYP2C19 (0.49) | CYP2C19ALDH1A1LMNAHSD17B10NPC1 | |
| SCHEMBL2652019 | 0.81 | CYP2C19 (0.44) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL20554137 | 0.80 | CYP3A4 (0.51) | CYP2C19NSD1HSD17B10CSNK2A1MAPT | |
| SCHEMBL23196255 | 0.76 | CYP2C19 (0.39) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL23195868 | 0.76 | NPC1 (0.42) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL21264331 | 0.76 | TOP2A (0.41) | CYP2C19NSD1ALDH1A1LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0614915-B1 | Polymer scale preventive agent | SHINETSU CHEMICAL CO (JP) | 1998-06-24 | — | — | EP | disclosed |
| US-5420214-A | Process to prevent scale adhesion using condensation product of a diamino heterocyclic and a quinone | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-05-30 | — | — | US | disclosed |
| EP-0614915-A1 | Polymer scale preventive agent | Shin-Etsu Chemical Co., Ltd. (JP) | 1994-09-14 | — | — | EP | disclosed |