Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5665989 | 0.89 | MAOA (0.39) | MAOAMAOBHSD11B1CES2CES1 | |
| SCHEMBL11275223 | 0.74 | SIGMAR1 (0.39) | HSD11B1CYP3A4 | |
| SCHEMBL229497 | 0.74 | PPARG (0.42) | MAOAMAOBHSD11B1CES2CES1 | |
| SCHEMBL11498993 | 0.74 | MAOA (0.43) | MAOAMAOBHSD11B1ALDH1A1LMNA | |
| SCHEMBL14779625 | 0.73 | MAOA (0.46) | MAOAMAOBLMNA | |
| SCHEMBL7383125 | 0.72 | PPARG (0.48) | MAOAMAOBLMNA | |
| SCHEMBL3568563 | 0.70 | PPARG (0.38) | MAOAMAOBHSD11B1CES2CES1 | |
| SCHEMBL7383873 | 0.70 | PPARG (0.47) | MAOAMAOBALDH1A1 | |
| SCHEMBL8704294 | 0.69 | MAOA (0.43) | MAOAMAOBOPRM1OPRL1 | |
| SCHEMBL923461 | 0.69 | MAOA (0.48) | MAOAMAOBHSD11B1CES2CES1 |
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-4801699-A | COATINGS, ADHESIVES, WET STRENGTH AGENTS IN PAPERMAKING | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1989-01-31 | — | — | US | disclosed |
| US-4749800-A | DIALKOXYPROPIONYL QUANIDINE | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1988-06-07 | — | — | US | disclosed |