Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6447784 | 0.91 | TSHR (0.60) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL6442664 | 0.84 | KDM4E (0.47) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL31620997 | 0.83 | KDM4E (0.58) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL6437918 | 0.81 | KDM4E (0.52) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL7718571 | 0.78 | CYP2D6 (0.51) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL4043732 | 0.78 | ALDH1A1 (0.48) | KDM4ETDP1TSHRCYP2D6KEAP1 | |
| SCHEMBL7718552 | 0.78 | MAPT (0.43) | TDP1NPC1RAB9A | |
| SCHEMBL4043734 | 0.76 | CYP2D6 (0.48) | KDM4ETDP1TSHRCYP2D6USP2 | |
| SCHEMBL3454630 | 0.75 | USP2 (0.67) | KDM4ETDP1CYP2D6USP2KEAP1 | |
| SCHEMBL5494919 | 0.75 | KDM4E (0.66) | KDM4ETDP1TSHRCYP2D6USP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009103719-A1 | SUBSTITUTED 4-(INDOL-3-YL)QUINAZOLINES AND USE AND PRODUCTION THEREOF | FREIE UNIVERSITÄT BERLIN (DE) | 2009-08-27 | — | — | WO | disclosed |