Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6950005 | 0.82 | KEAP1 (0.47) | MAPTKEAP1NFE2L2TSHRALDH1A1 | |
| SCHEMBL31267493 | 0.80 | MAPT (0.55) | MAPTHPGDTSHRALDH1A1PGR | |
| SCHEMBL19416820 | 0.78 | ALDH1A1 (0.60) | MAPTKEAP1HPGDALDH1A1PGR | |
| SCHEMBL8662811 | 0.77 | PKM (0.46) | KEAP1NFE2L2ALDH1A1PGRLMNA | |
| SCHEMBL28134996 | 0.76 | L3MBTL1 (0.61) | MAPTKEAP1NFE2L2HPGDTSHR | |
| SCHEMBL22089523 | 0.75 | TAS2R14 (0.59) | MAPTKEAP1TSHRALDH1A1LMNA | |
| SCHEMBL19848182 | 0.74 | KEAP1 (0.47) | KEAP1NFE2L2TSHRALDH1A1PGR | |
| SCHEMBL21734440 | 0.72 | KEAP1 (0.59) | KEAP1NFE2L2ALDH1A1PGRLMNA | |
| SCHEMBL21734725 | 0.72 | KEAP1 (0.60) | MAPTKEAP1NFE2L2PGR | |
| SCHEMBL8944093 | 0.72 | CA12 (0.48) | MAPTALDH1A1MEN1KMT2A |
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-1115729-A1 | PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B | Merck Frosst Canada & Co. (CA) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017211-A1 | PHOSPHONIC ACIDS DERIVATIVES AS INHIBITORS OF PTP-1B | MERCK FROSST CANADA & CO. (CA) | 2000-03-30 | — | — | WO | disclosed |