Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.44 |
| ▸ | TLR2 | O60603 | 1/20 | 0.42 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.42 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL23093145 | 0.82 | HAO1 (0.42) | ERN1TLR2TLR1TLR6TGFBR1 | |
| SCHEMBL23092929 | 0.79 | CA1 (0.47) | ERN1TLR2TLR1TLR6KMT2A | |
| SCHEMBL23092919 | 0.78 | ERN1 (0.41) | ERN1TLR2TLR1TLR6CA1 | |
| SCHEMBL24359763 | 0.76 | GABRA1 (0.50) | KMT2ATGFBR1CASP6KEAP1JMJD6 | |
| SCHEMBL23093177 | 0.76 | ERN1 (0.42) | ERN1TLR2TLR1TLR6CA1 | |
| SCHEMBL16439936 | 0.75 | ERN1 (0.67) | ERN1TLR2TLR1TLR6KMT2A | |
| SCHEMBL31152506 | 0.75 | ERN1 (0.67) | ERN1TLR2TLR1TLR6KMT2A | |
| SCHEMBL1095492 | 0.72 | KMT2A (0.55) | KMT2ATGFBR1CA1CA2CASP6 | |
| SCHEMBL23107944 | 0.72 | ERN1 (0.38) | ERN1TLR2TLR1TLR6KMT2A | |
| SCHEMBL7850495 | 0.71 | ERN1 (0.49) | ERN1TLR2TLR1TLR6KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021050688-A1 | COMPOUNDS AND USES THEREOF | X-CHEM, INC. (US) | 2021-03-18 | — | — | WO | disclosed |
| WO-2021050688-A1 | COMPOUNDS AND USES THEREOF | X-CHEM, INC. (US) | 2021-03-18 | — | — | WO | disclosed |