Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29944152 | 0.76 | CA2 (0.57) | SMN1; SMN2HTTKDM4EATMCYP19A1 | |
| SCHEMBL6461487 | 0.75 | SMN1; SMN2 (0.48) | SMN1; SMN2HTTKMT2AMEN1KDM4E | |
| SCHEMBL7951031 | 0.74 | ATM (0.58) | KMT2AKDM4EATMCYP19A1CYP1A2 | |
| SCHEMBL8713860 | 0.74 | HTT (0.47) | SMN1; SMN2HTTKMT2AMEN1KDM4E | |
| SCHEMBL5114907 | 0.74 | CA2 (0.59) | SMN1; SMN2HTTKDM4EATMCYP19A1 | |
| SCHEMBL28874223 | 0.73 | CA2 (0.53) | SMN1; SMN2HTTKMT2AMEN1KDM4E | |
| SCHEMBL11436624 | 0.73 | CNR1 (0.43) | HTTKMT2AMEN1KDM4EATM | |
| SCHEMBL8714131 | 0.72 | HTT (0.45) | SMN1; SMN2HTTKMT2AMEN1CYP19A1 | |
| SCHEMBL17963702 | 0.72 | TSHR (0.53) | SMN1; SMN2HTTATMCYP3A4LMNA | |
| SCHEMBL28409555 | 0.71 | CA2 (0.55) | SMN1; SMN2HTTKMT2AMEN1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0514851-A1 | N-acyl-tetrahydroisoquinolines as inhibitors of acyl-coenzyme a:cholesterol acyl transferase | SCHERING CORPORATION (US) | 1992-11-25 | — | — | EP | disclosed |