Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22472087 | 0.78 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1TSHRPDCD1CD274 | |
| SCHEMBL25195424 | 0.78 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1TSHRTDP1PDCD1 | |
| SCHEMBL11412780 | 0.76 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1TSHRTDP1PDCD1 | |
| SCHEMBL10535977 | 0.76 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1TSHRTDP1PDCD1 | |
| SCHEMBL8806890 | 0.70 | CA4 (0.41) | ALDH1A1L3MBTL1TSHRLMNACA4 | |
| SCHEMBL11444389 | 0.70 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1TDP1MAOAHTR2A | |
| SCHEMBL25434676 | 0.69 | TACR1 (0.33) | ALDH1A1L3MBTL1TSHRLMNA | |
| SCHEMBL7103289 | 0.67 | TDP1 (0.38) | ALDH1A1L3MBTL1TSHRTDP1LMNA | |
| SCHEMBL18486594 | 0.67 | CA4 (0.38) | ALDH1A1L3MBTL1TSHRTDP1LMNA | |
| SCHEMBL25195168 | 0.65 | CA4 (0.37) | ALDH1A1L3MBTL1TSHRLMNACA4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4841087-A | DISSOLVING ACRYLONITRILE IN SOLVENT WITH ORGANIC PHOSPHORUS(III) CATALYST TO PRODUCE 1,4 DICYANOBUTENES | MONSANTO COMPANY (US) | 1989-06-20 | — | — | US | claimed |
| CN-117295752-A | Monomers, polymerizable compositions, and polymers derived therefrom | 3M创新有限公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-116490538-A | Curable composition, syntactic foam, method of preparing syntactic foam, and article comprising syntactic foam | 3M创新有限公司 | 2023-07-25 | — | — | CN | disclosed |