Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 3/20 | 0.32 |
| ▸ | CNR2 | P34972 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11703622 | 0.98 | CA1 (0.34) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL11703166 | 0.83 | CNR2 (0.38) | CA1CA2MEN1KMT2ACNR1 | |
| SCHEMBL11699907 | 0.81 | CNR2 (0.39) | MEN1KMT2ACNR1CNR2CYP1A2 | |
| SCHEMBL11705035 | 0.81 | LMNA (0.41) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL11703604 | 0.73 | CA1 (0.37) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL16018021 | 0.71 | CHRM1 (0.41) | MEN1KMT2ACNR1CNR2HTR2B | |
| SCHEMBL28253756 | 0.71 | ROCK2 (0.43) | GABRA1GABRB2LMNACNR1CNR2 | |
| SCHEMBL2046211 | 0.70 | ALDH1A1 (0.32) | CA1CA2 | |
| SCHEMBL3133781 | 0.70 | CHRM1 (0.39) | CNR1CNR2HTR2BCHRM1ADRA1A | |
| SCHEMBL27698484 | 0.69 | CA1 (0.48) | CA1CA2GABRA1GABRB1GABRB2 |
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-4013473-A | THERMOGRAPHY, SUBSTITUTED PHENOL REDUCING AGENT | AGFA-GEVAERT N.V. (BE) | 1977-03-22 | — | — | US | disclosed |