Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SCN1A | P35498 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044993 | 0.85 | KDM4E (0.49) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL7718571 | 0.84 | CYP2D6 (0.51) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL6442664 | 0.84 | KDM4E (0.47) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL11642461 | 0.77 | KDM4E (0.46) | POLBKDM4ETDP1ALDH1A1MEN1 | |
| SCHEMBL6447784 | 0.76 | TSHR (0.60) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL4047895 | 0.76 | KDM4E (0.53) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL4043732 | 0.74 | ALDH1A1 (0.48) | CYP2D6TSHRPOLBKDM4ETDP1 | |
| SCHEMBL7718548 | 0.73 | CYP2D6 (0.50) | CYP2D6TSHRPOLBLMNAKDM4E | |
| SCHEMBL6437918 | 0.73 | KDM4E (0.52) | CYP2D6TSHRLMNAKDM4ETDP1 | |
| SCHEMBL28824456 | 0.72 | CYP2D6 (0.49) | CYP2D6TSHRLMNAKDM4ECYP3A4 |
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 |