Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL27867499 | 0.89 | AGTR2 (0.38) | NOTUMAGTR2 | |
| SCHEMBL27867447 | 0.88 | OPRD1 (0.43) | AGTR2 | |
| SCHEMBL27883822 | 0.80 | OPRD1 (0.43) | AGTR2 | |
| SCHEMBL27867498 | 0.78 | AGTR2 (0.51) | AGTR2 | |
| SCHEMBL1445011 | 0.76 | ACE (0.51) | — | |
| SCHEMBL27867411 | 0.76 | MMP8 (0.42) | AGTR2 | |
| Guanidine SCHEMBL8690427 | 0.76 | NOTUM (0.39) | NOTUMMAPK1ALDH1A1HTTNPC1 | |
| SCHEMBL27883807 | 0.76 | AADAT (0.43) | NOTUMAGTR2 | |
| SCHEMBL27883831 | 0.75 | XIAP (0.42) | AGTR2MEN1KMT2ALMNATSHR | |
| SCHEMBL30147482 | 0.75 | SMN1; SMN2 (0.41) | MAPK1ALDH1A1HTTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102639497-A | Compounds inhibitors of enzyme lactate dehydrogenase (LDH) and pharmaceutical compositions containing these compounds | UNIV PISA | 2012-08-15 | — | — | CN | disclosed |