Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.32 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.32 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.32 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.32 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.31 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL8272305 | 0.84 | ALDH1A1 (0.38) | MEN1KMT2AMAPTTDP1HTT | |
| SCHEMBL2928164 | 0.81 | HPGD (0.50) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL8265997 | 0.80 | SIRT5 (0.37) | MEN1KMT2AMAPTTDP1HTT | |
| SCHEMBL2932823 | 0.77 | PDE7A (0.49) | MEN1KMT2AMAPTTDP1ALDH1A1 | |
| SCHEMBL8271839 | 0.77 | ALDH1A1 (0.40) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL8272056 | 0.74 | ALDH1A1 (0.39) | MEN1KMT2AMAPTTDP1HTT | |
| SCHEMBL8267130 | 0.70 | FFAR1 (0.38) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL3362982 | 0.65 | ALDH1A1 (0.43) | MEN1KMT2AMAPTTDP1HTT | |
| SCHEMBL15481223 | 0.65 | HTT (0.44) | MEN1KMT2AMAPTTDP1HTT | |
| SCHEMBL2904377 | 0.65 | ALDH1A1 (0.56) | MEN1KMT2AMAPTTDP1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006017844-A1 | NOVEL 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF β-SECRETASE (BACE) | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-02-16 | — | — | WO | disclosed |
| WO-2006017836-A2 | 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-02-16 | — | — | WO | disclosed |