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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.68 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL27342421 | 0.96 | SPHK2 (0.63) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Hexane SCHEMBL7755378 | 0.96 | SPHK2 (0.63) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Hexane SCHEMBL28009759 | 0.93 | SPHK2 (0.60) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Dodecylamine SCHEMBL27696549 | 0.88 | DNM1 (0.72) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Octadecylamine SCHEMBL28250639 | 0.88 | DNM1 (0.72) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Guanidine SCHEMBL21067307 | 0.88 | DNM1 (0.72) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Guanidine SCHEMBL28700657 | 0.88 | DNM1 (0.72) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Pentadecane SCHEMBL28629536 | 0.87 | SPHK2 (0.62) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Heptane SCHEMBL28877230 | 0.86 | SPHK2 (0.54) | SPHK2SPHK1TSHRTHRBDNM1 | |
| Guanidine SCHEMBL28102223 | 0.86 | TSHR (0.68) | SPHK2SPHK1TSHRTHRBDNM1 |
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-1035875-C | Fungicidal (2-aryl-2-substituted) ethyl-1,2,4-triazoles | ROHM & HAAS (US) | 1997-09-17 | — | — | CN | disclosed |
| CN-1082032-A | Mycocidal (ethyl 1,2 that 2-aryl-2-replaces, 4-triazole | ROHM & HAAS (US) | 1994-02-16 | — | — | CN | disclosed |