Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.57 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.54 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229444 | 0.97 | EGFR (0.55) | EGFRERBB2HPGDGAALPAR1 | |
| SCHEMBL10144056 | 0.94 | HPGD (0.64) | EGFRERBB2HPGDGAALPAR1 | |
| SCHEMBL14200268 | 0.90 | EGFR (0.49) | EGFRERBB2HPGDGAALPAR1 | |
| SCHEMBL6674114 | 0.88 | EGFR (0.70) | EGFRERBB2HPGDGAAHDAC1 | |
| SCHEMBL27709184 | 0.86 | BMP1 (0.52) | HPGDGAALPAR1LPAR5HDAC1 | |
| SCHEMBL11213030 | 0.85 | OPRM1 (0.56) | HPGDGAALPAR1TSHROPRM1 | |
| SCHEMBL9888801 | 0.85 | DRD2 (0.50) | HPGDLPAR1LPAR5HDAC1OPRM1 | |
| SCHEMBL11757402 | 0.85 | OPRM1 (0.56) | HPGDGAALPAR1TSHROPRM1 | |
| SCHEMBL19997006 | 0.85 | DRD2 (0.61) | HPGDHDAC1HDAC3HDAC2CES2 | |
| SCHEMBL6023472 | 0.83 | CES2 (0.52) | HPGDLPAR1LPAR5HDAC1HDAC3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106278775-A | The preparation method of a kind of arylamides and purification method thereof | 温州大学 | 2017-01-04 | — | — | CN | disclosed |
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |