Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 5/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL29950515 | 0.88 | CA2 (0.53) | CA1CA2ZDHHC7TAS1R3TAS1R1 | |
| SCHEMBL29955967 | 0.85 | CA1 (0.39) | CA1CA2ZDHHC7SMN1; SMN2TSHR | |
| SCHEMBL29956933 | 0.85 | ZDHHC7 (0.56) | CA1CA2ZDHHC7ABCB1KMT2A | |
| SCHEMBL9832435 | 0.83 | — | — | |
| SCHEMBL29956277 | 0.80 | GABRP (0.38) | CA1CA2TSHRKMT2A | |
| SCHEMBL29951369 | 0.79 | CA1 (0.32) | CA1CA2ZDHHC7SMN1; SMN2 | |
| SCHEMBL29950857 | 0.79 | CA1 (0.35) | CA1CA2ZDHHC7SMN1; SMN2 | |
| SCHEMBL29956397 | 0.79 | L3MBTL1 (0.41) | TAS1R3TAS1R1CYP3A4KMT2AUSP2 | |
| SCHEMBL29956292 | 0.78 | — | — | |
| SCHEMBL29668156 | 0.77 | ZDHHC7 (0.36) | CA1CA2ZDHHC7USP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| US-4261731-A | Alpha-isocyano-carboxylic acid amide compounds and plant growth regulant compositions | BAYER AKTIENGESELLSCHAFT (DE) | 1981-04-14 | — | — | US | disclosed |