Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27636901 | 0.87 | CTBP2 (0.43) | HTTMEN1KMT2AMAPTKDM4E | |
| SCHEMBL27617796 | 0.84 | FFAR1 (0.45) | CYP19A1FFAR1SLC5A1SLC5A2MAPT | |
| SCHEMBL27617799 | 0.82 | CYP19A1 (0.49) | CYP19A1SLC5A1SLC5A2MEN1KMT2A | |
| SCHEMBL27617791 | 0.82 | CYP19A1 (0.55) | CYP19A1FFAR1HTTSLC5A1SLC5A2 | |
| SCHEMBL28757643 | 0.79 | CYP19A1 (0.45) | CYP19A1FFAR1HTTSLC5A1SLC5A2 | |
| SCHEMBL27617814 | 0.75 | NPC1 (0.53) | CYP19A1HTTSLC5A1SLC5A2MAPT | |
| SCHEMBL27636907 | 0.75 | TSHR (0.39) | CYP19A1FFAR1KDM4EALDH1A1LMNA | |
| SCHEMBL10671478 | 0.75 | GSK3B (0.59) | FFAR1HTTMMP12MMP13GSK3B | |
| SCHEMBL6761458 | 0.73 | HPGD (0.50) | CYP19A1HTTMEN1KMT2AMAPT | |
| SCHEMBL7338789 | 0.72 | FFAR1 (0.53) | FFAR1HTTMMP12MMP13TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1717409-A | Pyrazolonaphthyridine derivative | GRELAN PHARMACEUTICAL CO (JP) | 2006-01-04 | — | — | CN | disclosed |