Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.49 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.43 |
| ▸ | HNF4A | P41235 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6241860 | 0.85 | TSHR (0.59) | CYP3A4TSHRHPRT1ALDH1A1NCEH1 | |
| SCHEMBL15811045 | 0.83 | NPC1 (0.47) | CYP3A4TSHRHPRT1CA1CA2 | |
| SCHEMBL17987523 | 0.83 | TSHR (0.53) | CYP3A4TSHRHPRT1ALDH1A1ESR1 | |
| SCHEMBL19636325 | 0.82 | HNF4A (0.46) | CYP3A4TSHRHPRT1ALDH1A1ESR1 | |
| SCHEMBL19660707 | 0.82 | HNF4A (0.52) | CYP3A4TSHRALDH1A1ESR1HNF4A | |
| SCHEMBL19831832 | 0.82 | CYP3A4 (0.46) | CYP3A4TSHRHPRT1ALDH1A1NCEH1 | |
| SCHEMBL19383197 | 0.81 | TSHR (0.46) | CYP3A4TSHRHPRT1ALDH1A1NCEH1 | |
| SCHEMBL19636323 | 0.80 | TSHR (0.45) | CYP3A4TSHRHPRT1ALDH1A1ESR1 | |
| SCHEMBL15811164 | 0.79 | CYP3A4 (0.41) | CYP3A4TSHRHPRT1ALDH1A1ESR1 | |
| SCHEMBL28670572 | 0.79 | ERN1 (0.47) | GSTP1ALDH1A1ESR1ESR2HDAC4 |
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-2016175533-A2 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME | 덕산네오룩스 주식회사 | 2016-11-03 | — | — | WO | disclosed |