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 | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.81 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.60 |
| ▸ | DAO | P14920 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PHGDH | O43175 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.49 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8600262 | 0.92 | MCL1 (0.96) | MCL1SLC9A1DAOALDH1A1KDM4E | |
| SCHEMBL117186 | 0.90 | MCL1 (1.00) | MCL1SLC9A1DAOALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL28264080 | 0.83 | MCL1 (0.69) | MCL1SLC9A1DAOMAPTMEN1 | |
| SCHEMBL2323444 | 0.82 | MCL1 (0.71) | MCL1SLC9A1DAOMAPTPHGDH | |
| SCHEMBL3804327 | 0.82 | MCL1 (0.61) | MCL1SLC9A1DAOALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL8495806 | 0.81 | MCL1 (0.56) | MCL1SLC9A1MAPTPHGDHMEN1 | |
| SCHEMBL3486848 | 0.80 | MCL1 (0.79) | MCL1SLC9A1DAOALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL8688093 | 0.80 | MCL1 (0.55) | MCL1SLC9A1MAPTPHGDHMEN1 | |
| SCHEMBL3714299 | 0.79 | MCL1 (0.58) | MCL1SLC9A1MAPTPHGDHMEN1 | |
| SCHEMBL5748064 | 0.78 | MCL1 (0.71) | MCL1SLC9A1DAOMAPTPHGDH |
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 |
|---|---|---|---|---|---|---|---|
| US-5852046-A | Benzo-fused heterocyclic compounds having a 5-membered ring processes for their preparation their use as medicaments their use as diagnostic agents and medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | disclosed |