Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL147990 | 0.80 | KIF11 (0.65) | KIF11KCNN4ALDH1A1POLBCYP1A2 | |
| SCHEMBL284800 | 0.78 | KIF11 (0.47) | KIF11KCNN4ALDH1A1TSHRPOLB | |
| SCHEMBL2346951 | 0.75 | KCNN4 (0.47) | KIF11KCNN4ALDH1A1POLBCYP2C19 | |
| Hydrochloric Acid SCHEMBL7623200 | 0.73 | KIF11 (0.47) | KIF11KCNN4ALDH1A1POLBCYP1A2 | |
| SCHEMBL6399480 | 0.72 | TSHR (0.52) | KIF11KCNN4ALDH1A1TSHRPTPN1 | |
| SCHEMBL11981658 | 0.72 | TP53BP1 (0.37) | KIF11ALDH1A1TSHRCYP1A2MEN1 | |
| SCHEMBL2493446 | 0.71 | KIF11 (0.59) | KIF11KCNN4ALDH1A1POLBMEN1 | |
| SCHEMBL20710206 | 0.71 | KIF11 (0.53) | KIF11KCNN4ALDH1A1POLBMEN1 | |
| SCHEMBL22200647 | 0.70 | TSHR (0.50) | KIF11KCNN4ALDH1A1TSHRPTPN1 | |
| SCHEMBL3684180 | 0.69 | KIF11 (0.57) | KIF11KCNN4ALDH1A1TSHRPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012013848-A1 | DIFLUOROBENZYL ETHANOLAMINE DERIVATIVES WITH ANTIMICROBIAL ACTIVITY | FUNDACIÓN DE LA COMUNIDAD VALENCIANA "CENTRO DE INVESTIGACIÓN PRÍNCIPE FELIPE" (ES) | 2012-02-02 | — | — | WO | disclosed |