Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | F9 | P00740 | 2/20 | 0.33 |
| ▸ | EIF4E | P06730 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18553430 | 0.89 | ALDH1A1 (0.43) | TDP1ALDH1A1HPRT1CASP6MEN1 | |
| SCHEMBL18553509 | 0.88 | PTGES (0.35) | TDP1HPRT1ESR1ESR2CASP6 | |
| SCHEMBL18121135 | 0.83 | HPRT1 (0.40) | TDP1ALDH1A1HPRT1ESR1ESR2 | |
| SCHEMBL19660663 | 0.82 | ALDH1A1 (0.41) | TDP1ALDH1A1HPRT1CRHBPCRHR2 | |
| SCHEMBL25883443 | 0.81 | TDP1 (0.38) | TDP1ALDH1A1HPRT1CRHBPCRHR2 | |
| SCHEMBL18666520 | 0.81 | HPRT1 (0.39) | TDP1ALDH1A1HPRT1CRHBPCRHR2 | |
| SCHEMBL26536479 | 0.81 | ALDH1A1 (0.42) | TDP1ALDH1A1HPRT1CRHBPCRHR2 | |
| SCHEMBL19832037 | 0.79 | HPRT1 (0.45) | TDP1ALDH1A1HPRT1ESR1CASP6 | |
| SCHEMBL18666050 | 0.79 | KDM4E (0.33) | ALDH1A1HPRT1MEN1KMT2A | |
| SCHEMBL13562148 | 0.78 | F9 (0.42) | TDP1ALDH1A1HPRT1ESR1ESR2 |
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-2017030307-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS COMPRISING SAME | 덕산네오룩스 주식회사 | 2017-02-23 | — | — | WO | disclosed |