Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 1/20 | 0.48 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
| ▸ | BCL2 | P10415 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4533749 | 0.96 | AGXT (0.52) | AGXTGPR84BCL2BACE1CTSS | |
| SCHEMBL10078136 | 0.94 | AGXT (0.50) | AGXTGPR84BCL2BACE1CTSS | |
| SCHEMBL24005570 | 0.92 | CTSS (0.50) | AGXTBCL2BACE1CTSSCTSK | |
| SCHEMBL196298 | 0.89 | CTSS (0.51) | AGXTBCL2CTSSCTSKKIF11 | |
| SCHEMBL30777855 | 0.89 | CTSS (0.51) | AGXTBCL2CTSSCTSKKIF11 | |
| SCHEMBL25382633 | 0.87 | MAOA (0.56) | MAOAMAOBKIF11KCNH2ALDH1A1 | |
| SCHEMBL15238584 | 0.86 | MCL1 (0.49) | BCL2BACE1CTSSCTSKMAOB | |
| Formic Acid SCHEMBL27427404 | 0.85 | GPR84 (0.49) | AGXTGPR84BCL2BACE1GGPS1 | |
| SCHEMBL11515483 | 0.84 | PSMB5 (0.49) | AGXTBCL2GGPS1 | |
| SCHEMBL30500519 | 0.84 | PSMB5 (0.49) | AGXTBCL2GGPS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2111223-A1 | AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2009-10-28 | — | — | EP | disclosed |
| WO-2009058216-A1 | AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2009-05-07 | — | — | WO | disclosed |