Known targets — ChEMBL curated mechanism
KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2
The experimentally established mechanism targets of Guanidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 3/20 | 0.36 |
| ▸ | NOS1 | P29475 | 3/20 | 0.36 |
| ▸ | NOS2 | P35228 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Guanidine SCHEMBL1933907 | 0.86 | — | — | |
| Benzene SCHEMBL28326043 | 0.83 | TSHR (0.43) | ALDH1A1TSHRCYP2C19NOS3NOS1 | |
| Carbamic Acid SCHEMBL8333796 | 0.82 | — | — | |
| Carbamic Acid SCHEMBL11744787 | 0.82 | ACHE (0.58) | ALDH1A1TSHRFFAR3CYP2C19ACHE | |
| Guanidine SCHEMBL28290540 | 0.82 | TSHR (0.50) | ALDH1A1TSHRCYP2C19NOS3NOS1 | |
| Guanidine SCHEMBL4296464 | 0.82 | — | — | |
| Guanidine SCHEMBL14677179 | 0.82 | ACHE (0.55) | ALDH1A1TSHRFFAR3CYP2C19ACHE | |
| Guanidine SCHEMBL5102 | 0.82 | — | — | |
| Bicarbonate SCHEMBL28807965 | 0.82 | ALDH1A1 (0.60) | ALDH1A1TSHRFFAR3LMNATDP1 | |
| Guanidine SCHEMBL1319550 | 0.82 | ACHE (0.55) | ALDH1A1TSHRFFAR3CYP2C19ACHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-104016979-B | Substituted cyclic compound as well as use method and application thereof | 广东东阳光药业有限公司 | 2017-05-03 | — | — | CN | disclosed |
| EP-2420476-A1 | ACTINOID OXIDE CRYSTAL MANUFACTURING METHOD | Tohoku University (JP) | 2012-02-22 | — | — | EP | disclosed |