Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | CHRM2 | P08172 | 13/20 | 0.62 |
| ▸ | BCHE | P06276 | 5/20 | 0.62 |
| ▸ | ACHE | P22303 | 5/20 | 0.62 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.62 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.62 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.62 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.62 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.62 |
| ▸ | RECQL | P46063 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | THPO | P40225 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL5695121 | 0.90 | ALDH1A1 (0.79) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL3206294 | 0.86 | ALDH1A1 (0.51) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL2782788 | 0.85 | ALDH1A1 (0.58) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL4918396 | 0.82 | CHRM2 (0.79) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL8883322 | 0.81 | KDM4E (0.70) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL3130371 | 0.81 | CHRM2 (0.66) | KDM4EALDH1A1CHRM2BCHEACHE | |
| SCHEMBL4913173 | 0.81 | CHRM2 (0.83) | CHRM2BCHEACHECHRM4CHRM5 | |
| SCHEMBL4918181 | 0.81 | CHRM2 (0.83) | CHRM2BCHEACHECHRM4CHRM5 | |
| SCHEMBL5035489 | 0.81 | CHRM2 (0.83) | CHRM2BCHEACHECHRM4CHRM5 | |
| SCHEMBL3197983 | 0.80 | ALDH1A1 (0.57) | KDM4EALDH1A1CYP3A4CYP2D6TSHR |
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-1917244-A2 | HETARYL-SUBSTITUTED GUANIDINE COMPOUNDS AND USE THEREOF AS BINDING PARTNERS FOR 5-HT5-RECEPTORS | Abbott GmbH & Co. KG (DE) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007022964-A2 | HETARYL-SUBSTITUTED GUANIDINE COMPOUNDS AND USE THEREOF AS BINDING PARTNERS FOR 5-HT5-RECEPTORS | ABBOTT GMBH & CO. KG (DE) | 2007-03-01 | — | — | WO | disclosed |