Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9535856 | 0.76 | PPARG (0.48) | CA1CA2ACHEPPARGPPARD | |
| SCHEMBL7430435 | 0.76 | PPARG (0.51) | CA1CA2ACHEPPARGPPARD | |
| SCHEMBL9662716 | 0.74 | MAPT (0.49) | KMT2ANPSR1L3MBTL1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9661830 | 0.73 | MAPT (0.48) | KMT2ANPSR1L3MBTL1SMN1; SMN2ALDH1A1 | |
| SCHEMBL9734552 | 0.71 | CYP3A4 (0.72) | CYP1A2KMT2ACYP2C9SMN1; SMN2CYP3A4 | |
| Hydrochloric Acid SCHEMBL6572276 | 0.71 | KCNH2 (0.49) | CA1CA2ACHEKMT2ASMN1; SMN2 | |
| SCHEMBL28219379 | 0.70 | BCHE (0.48) | ACHECYP1A2CYP2C9L3MBTL1SMN1; SMN2 | |
| SCHEMBL9263967 | 0.69 | LTB4R (0.38) | ACHEPPARGPPARDPPARACYP1A2 | |
| SCHEMBL12296384 | 0.68 | ACHE (0.48) | CA1CA2ACHEPPARGPPARD | |
| SCHEMBL8867397 | 0.68 | ACHE (0.54) | CA1CA2ACHEPPARGPPARD |
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-1041361-A | The preparation of b-sulfonamide derivative | ORTHO PHARMA CORP (US) | 1990-04-18 | — | — | CN | claimed |
| CN-1041361-A | The preparation of b-sulfonamide derivative | ORTHO PHARMA CORP (US) | 1990-04-18 | — | — | CN | disclosed |