Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.42 |
| ▸ | IGF1R | P08069 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16408702 | 0.75 | ALK (0.52) | HPGDLMNAALDH1A1ALKIGF1R | |
| SCHEMBL15210468 | 0.62 | LMNA (0.48) | HPGDLMNAALDH1A1ALKIGF1R | |
| SCHEMBL16394514 | 0.61 | HPGD (0.48) | HPGDLMNAALDH1A1ALKIGF1R | |
| SCHEMBL14316007 | 0.59 | KDM4E (0.57) | HPGDLMNAALDH1A1KDM4ENPC1 | |
| SCHEMBL15022155 | 0.59 | ALK (1.00) | ALKIGF1R | |
| SCHEMBL13162836 | 0.57 | ITGB3 (0.51) | HPGDLMNAALDH1A1KDM4ENPC1 | |
| SCHEMBL23857926 | 0.56 | ALDH1A1 (0.63) | LMNAALDH1A1KDM4ENPC1RAB9A | |
| Oxalic Acid SCHEMBL9348857 | 0.55 | ITGB3 (0.52) | HPGDLMNAALDH1A1NPC1RAB9A | |
| SCHEMBL14788156 | 0.55 | KMT2A (0.47) | ALDH1A1KDM4ENPC1RAB9AKMT2A | |
| SCHEMBL30919618 | 0.54 | KDM4E (0.46) | HPGDLMNAKDM4EPOLBGPBAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2817310-B1 | 8-SUBSTITUTED 2-AMINO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2018-03-21 | — | — | EP | disclosed |