Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.36 |
| ▸ | CDK4 | P11802 | 2/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.36 |
| ▸ | CCND1 | P24385 | 2/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 3/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.36 |
| ▸ | PTGER3 | P43115 | 3/20 | 0.36 |
| ▸ | PTGER2 | P43116 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8406052 | 0.82 | LCK (0.48) | LCKNFE2L2PPARGCYP1A1CYP1A2 | |
| SCHEMBL8406054 | 0.82 | LCK (0.48) | LCKNFE2L2PPARGCYP1A1CYP1A2 | |
| SCHEMBL28565356 | 0.79 | KDM1A (0.48) | KDM1ANFE2L2CYP1A2KDM4EPKM | |
| SCHEMBL4155559 | 0.79 | KDM1A (0.47) | KDM1ANFE2L2CYP1A2KDM4EALDH1A1 | |
| SCHEMBL2773355 | 0.79 | KDM1A (0.47) | KDM1ANFE2L2CYP1A2KDM4EALDH1A1 | |
| SCHEMBL1759276 | 0.78 | NPC1 (0.42) | GRM5CCNB2CDK1CDK4CCNB1 | |
| SCHEMBL1638868 | 0.77 | NFE2L2 (0.59) | LCKNFE2L2CYP1A1CYP1A2CYP19A1 | |
| SCHEMBL28284783 | 0.77 | GRM5 (0.41) | GRM5CYP1A2MAOBKDM4EALDH1A1 | |
| SCHEMBL1759281 | 0.76 | TLR4 (0.42) | KDM1ALCKNFE2L2GRM5CYP1A1 | |
| SCHEMBL8409750 | 0.75 | PTGER4 (0.56) | LCKNFE2L2PPARGCYP1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2493933-A2 | CATALYST COMPOUNDS AND USE THEREOF | ExxonMobil Chemical Patents Inc. (US) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011056424-A2 | CATALYST COMPOUNDS AND USE THEREOF | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2011-05-12 | — | — | WO | disclosed |