Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11502 | 0.84 | RAB9A (0.54) | RAB9ANPC1SMN1; SMN2SMYD3EPHX2 | |
| SCHEMBL18531883 | 0.82 | TDP1 (0.41) | RAB9ANPC1SMN1; SMN2CNR2ALDH1A1 | |
| SCHEMBL11981515 | 0.81 | NPC1 (0.40) | RAB9ANPC1SMN1; SMN2SMYD3CNR2 | |
| SCHEMBL20614302 | 0.81 | SMN1; SMN2 (0.40) | RAB9ANPC1SMN1; SMN2SMYD3EPHX2 | |
| SCHEMBL20124157 | 0.80 | SMN1; SMN2 (0.55) | SMN1; SMN2EPHX2ALDH1A1MEN1KMT2A | |
| SCHEMBL18531828 | 0.80 | EPHX1 (0.45) | RAB9ANPC1SMN1; SMN2SMYD3EPHX2 | |
| SCHEMBL14652083 | 0.79 | SMYD3 (0.50) | SMN1; SMN2SMYD3 | |
| SCHEMBL14652086 | 0.77 | SMN1; SMN2 (0.44) | RAB9ASMN1; SMN2SMYD3CNR2ALDH1A1 | |
| SCHEMBL20030343 | 0.76 | ALOX5 (0.31) | SMYD3 | |
| SCHEMBL26445141 | 0.75 | SMN1; SMN2 (0.44) | RAB9ASMN1; SMN2SMYD3CNR2ALDH1A1 |
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-2488532-B1 | ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | MELINTA THERAPEUTICS INC (US) | 2018-05-09 | — | — | EP | disclosed |