Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 8/20 | 0.48 |
| ▸ | LDHB | P07195 | 6/20 | 0.42 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10212046 | 0.87 | LDHA (0.43) | LDHALDHBKMOABL1BCR | |
| SCHEMBL10212526 | 0.86 | SMN1; SMN2 (0.40) | LDHALDHBALDH1A1GAANPC1 | |
| SCHEMBL18019293 | 0.85 | LDHA (0.52) | LDHALDHBKMOIKBKBCHUK | |
| SCHEMBL15131309 | 0.81 | LDHA (0.49) | LDHALDHBKMOIKBKBCHUK | |
| SCHEMBL18267291 | 0.76 | ABCG2 (0.44) | LDHALDHBIKBKBCHUKALDH1A1 | |
| SCHEMBL28859450 | 0.72 | ACMSD (0.51) | LDHALDHBALDH1A1 | |
| SCHEMBL30041404 | 0.72 | ACMSD (0.51) | LDHALDHBALDH1A1 | |
| SCHEMBL10212528 | 0.72 | SYK (0.42) | KMOALDH1A1LMNAGAAMEN1 | |
| SCHEMBL20256974 | 0.71 | LDHA (0.45) | LDHALDHBKMOALDH1A1MEN1 | |
| SCHEMBL19928398 | 0.71 | LDHA (0.49) | LDHALDHBKMOALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012042433-A1 | N1-PYRAZOLOSPIROKETONE ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-04-05 | — | — | WO | disclosed |