Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.42 |
| ▸ | CCR5 | P51681 | 3/20 | 0.42 |
| ▸ | CCR8 | P51685 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8739634 | 1.00 | CCR1 (0.42) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL14470002 | 0.94 | TGFBR1 (0.41) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL16588446 | 0.94 | CCR1 (0.38) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL19221741 | 0.89 | CCR1 (0.34) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL15580522 | 0.87 | NPY5R (0.33) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL26319904 | 0.87 | TGFBR1 (0.37) | CCR1CCR5CCR8KDM4ESMN1; SMN2 | |
| SCHEMBL18697615 | 0.82 | CYP3A4 (0.32) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL24626905 | 0.81 | MEN1 (0.33) | KDM4ELMNASMN1; SMN2RAB9ANPC1 | |
| SCHEMBL23081870 | 0.81 | MEN1 (0.33) | KDM4ELMNASMN1; SMN2RAB9ANPC1 | |
| SCHEMBL29660049 | 0.78 | CCR1 (0.64) | CCR1CCR5CCR8KDM4ELMNA |
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-2016068478-A2 | CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2016-05-06 | — | — | WO | disclosed |