Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 13/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL10018885 | 0.92 | PDK2 (0.38) | PDK2 | |
| SCHEMBL18086207 | 0.88 | GPR3 (0.40) | PDK2MAPTSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL25937134 | 0.87 | GPR3 (0.37) | PDK2MAPTSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL14101564 | 0.86 | PDK2 (0.35) | PDK2 | |
| SCHEMBL14305892 | 0.84 | PDK2 (0.51) | PDK2MAPTSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL16801663 | 0.84 | PDK2 (0.34) | PDK2 | |
| SCHEMBL14101558 | 0.84 | LPL (0.36) | PDK2SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL17119051 | 0.84 | PDK2 (0.35) | PDK2 | |
| SCHEMBL5019792 | 0.84 | KDM4E (0.40) | PDK2MAPTALDH1A1RAB9AKDM4E | |
| SCHEMBL20277500 | 0.83 | GPR3 (0.44) | MAPTSMN1; SMN2ALDH1A1RAB9AHPGD |
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-2012030145-A1 | NOVEL COMPOUNDS FOR ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2012-03-08 | — | — | WO | disclosed |