Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL27633250 | 0.85 | ALOX5 (0.50) | ALOX5ALDH1A1SLC1A3SLC1A2SLC1A1 | |
| Trifluoroacetic Acid SCHEMBL27502379 | 0.81 | ALDH1A1 (0.48) | MLYCDALOX5ALDH1A1POLBKMT2A | |
| SCHEMBL43101 | 0.80 | — | — | |
| Propionic Acid SCHEMBL30718269 | 0.80 | ALDH1A1 (0.47) | ALOX5ALDH1A1SLC1A3SLC1A2SLC1A1 | |
| Trifluoroacetic Acid SCHEMBL4806415 | 0.79 | GRB2 (0.50) | MLYCDALOX5SLC1A3SLC1A2SLC1A1 | |
| Acrylic Acid SCHEMBL30718238 | 0.79 | ALOX5 (0.45) | ALOX5ALDH1A1SLC1A3SLC1A2SLC1A1 | |
| Formaldehyde SCHEMBL9312051 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL2389399 | 0.78 | — | — | |
| Methane SCHEMBL28113921 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL28482817 | 0.78 | — | — |
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-1230225-A2 | PHARMACEUTICALLY ACTIVE 4-SUBSTITUTED PYRIMIDINE DERIVATIVES | ELI LILLY AND COMPANY (US) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001032632-A2 | PHARMACEUTICALLY ACTIVE 4-SUBSTITUTED PYRIMIDINE DERIVATIVES | ELI LILLY AND COMPANY (US) | 2001-05-10 | — | — | WO | disclosed |