Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.31 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27623452 | 0.94 | CYP3A4 (0.36) | CYP3A4TSHRMAPK1GAAMAPT | |
| SCHEMBL27641583 | 0.80 | CD44 (0.42) | TSHRPOLBGAAMAPTRAB9A | |
| SCHEMBL27543700 | 0.78 | CFTR (0.39) | — | |
| SCHEMBL27539550 | 0.78 | GAA (0.33) | MAPK1GAAMAPT | |
| SCHEMBL27662009 | 0.78 | CFTR (0.36) | ADRB2LMNA | |
| SCHEMBL28032033 | 0.76 | ACHE (0.44) | CYP3A4TSHRMAPTTDP1ALDH1A1 | |
| SCHEMBL4016329 | 0.76 | TDP1 (0.42) | CYP3A4MAPTTDP1ALDH1A1RAB9A | |
| SCHEMBL27767915 | 0.76 | ALDH1A1 (0.47) | CYP3A4TDP1ALDH1A1RAB9AIMPDH2 | |
| SCHEMBL27767991 | 0.75 | RAB9A (0.45) | CYP3A4MAPK1MAPTAAK1ALDH1A1 | |
| SCHEMBL27761924 | 0.74 | TSHR (0.38) | CYP3A4TSHRIMPDH2IMPDH1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102584813-B | Compound and the purposes in regulating amyloid beta thereof | NGC药物公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-102584813-A | Compouds and uses thereof in modulating amyloid beta | TORREYPINES THERAPEUTICS INC | 2012-07-18 | — | — | CN | disclosed |
| CN-1787822-A | Compounds and their use in modulating amyloid beta | TORREYPINES THERAPEUTICS INC (US) | 2006-06-14 | — | — | CN | disclosed |