Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.31 |
| ▸ | NCOR1 | O75376 | 2/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28769146 | 0.95 | NPC1 (0.34) | EPHX2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27723968 | 0.93 | EPHX2 (0.37) | EPHX2AOC3POLBMAPTTHRB | |
| SCHEMBL27703389 | 0.92 | CNR1 (0.33) | EPHX2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4591425 | 0.92 | MAPT (0.37) | TAAR1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL27703435 | 0.91 | CHRM5 (0.36) | EPHX2TP53AOC3POLBMAPT | |
| SCHEMBL27703392 | 0.91 | POLB (0.33) | TAAR1EPHX2TP53NPC1RAB9A | |
| SCHEMBL27724115 | 0.90 | CYP3A4 (0.35) | EPHX2TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27703395 | 0.87 | CNR1 (0.42) | EPHX2AOC3POLBCNR1CYP3A4 | |
| SCHEMBL28773084 | 0.85 | EPHX2 (0.39) | EPHX2CNR1CYP3A4CNR2 | |
| SCHEMBL27703386 | 0.85 | CYP3A4 (0.38) | EPHX2TP53RAB9ASMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101189209-A | C5a receptor antagonists | JERINI AG (DE) | 2008-05-28 | — | — | CN | claimed |
| CN-101189209-A | C5a receptor antagonists | JERINI AG (DE) | 2008-05-28 | — | — | CN | disclosed |