Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrogen Sulfide. 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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.39 |
| ▸ | SNCA | P37840 | 2/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
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 SCHEMBL494 | 0.97 | SNCA (0.63) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28052521 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28005215 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Methane SCHEMBL28097927 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Phosphine SCHEMBL27546596 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Bromide SCHEMBL8331435 | 0.95 | SNCA (0.64) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27993385 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27987350 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28828301 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 | |
| Arsenic SCHEMBL27730172 | 0.95 | SNCA (0.61) | SNCAHIF1ACYP1A2EPHX1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105731437-B | A kind of exotic atom doped graphene and the preparation method and application thereof | 苏州大学 | 2019-01-08 | — | — | CN | disclosed |
| CN-107834078-A | A kind of exotic atom adulterates cellular porous carbon material and preparation method thereof | 山西大学 | 2018-03-23 | — | — | CN | disclosed |
| CN-105731437-A | Exotic-atom-doped graphene, and preparation method and application thereof | 苏州大学 | 2016-07-06 | — | — | CN | disclosed |