Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HBB | P68871 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCND2 | P30279 | 1/20 | 0.35 |
| ▸ | CCND3 | P30281 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18568328 | 0.76 | DHFR (0.61) | DHFRKDM4ETSHRTP53HBB | |
| SCHEMBL19455723 | 0.73 | AHR (0.35) | TSHRSMN1; SMN2ALDH1A1AHRHSD17B10 | |
| SCHEMBL22182105 | 0.72 | TDP1 (0.57) | KDM4ETSHRSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL1535702 | 0.68 | ALDH1A1 (0.65) | DHFRKDM4ETSHRTP53HBB | |
| SCHEMBL4507922 | 0.68 | ALDH1A1 (0.72) | KDM4ESMN1; SMN2ALDH1A1MAPTHSD17B10 | |
| SCHEMBL10720311 | 0.67 | DHFR (0.59) | DHFRKDM4ETSHRTP53HBB | |
| SCHEMBL29297667 | 0.67 | FEN1 (0.41) | KDM4EALDH1A1AHRHTTHSD17B10 | |
| SCHEMBL14169090 | 0.67 | KMT2A (0.41) | KDM4EALDH1A1MAPTAHRHTT | |
| SCHEMBL12968199 | 0.67 | HEXA (0.45) | KDM4ESMN1; SMN2ALDH1A1MAPTHSD17B10 | |
| SCHEMBL17281124 | 0.67 | ALDH1A1 (0.46) | TSHRSMN1; SMN2ALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-8188112-B2 | Naphthalamide derivatives having antiproliferative activity | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2012-05-29 | — | — | US | disclosed |