Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 1.00 |
| ▸ | MAPT | P10636 | 1/20 | 1.00 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | GPR3 | P46089 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | G6PD | P11413 | 1/20 | 0.47 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2098721 | 0.85 | MAPT (0.74) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL31265892 | 0.82 | HTT (0.69) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL14802158 | 0.81 | MAPT (0.68) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL10167907 | 0.79 | HTT (0.66) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL10977307 | 0.79 | HTT (0.66) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL382974 | 0.79 | HTT (0.66) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL3875044 | 0.79 | MAPT (0.63) | HTTMAPTHSD17B10ALDH1A1KDM4E | |
| SCHEMBL29466066 | 0.79 | GPR3 (0.71) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL53107 | 0.79 | GPR3 (0.71) | HTTMAPTCYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL21312375 | 0.79 | GPR3 (0.71) | HTTMAPTCYP2C19HSD17B10ALDH1A1 |
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-5296602-A | Condensing substituted ortho-halo- or ortho-aminobenzoic acid with meta-halo- or meta-aminoanisole, cyclizing, N-alkylating, de-O-methylating | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1994-03-22 | — | — | US | disclosed |
| WO-1992016509-A1 | MULTISUBSTITUTED 1-HYDROXY-9-ACRIDONES WITH ANTICANCER ACTIVITY | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1992-10-01 | — | — | WO | disclosed |