Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 2/20 | 0.57 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SNCA | P37840 | 1/20 | 0.46 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | CCR2 | P41597 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6170402 | 1.00 | METAP2 (0.57) | METAP2KEAP1NFE2L2MCL1CYP2C9 | |
| SCHEMBL6169289 | 0.90 | METAP2 (0.54) | METAP2KEAP1NFE2L2MCL1CYP2C9 | |
| SCHEMBL6169283 | 0.90 | METAP2 (0.54) | METAP2KEAP1NFE2L2MCL1CYP2C9 | |
| SCHEMBL6169064 | 0.88 | KEAP1 (0.49) | METAP2KEAP1NFE2L2SNCACCR2 | |
| SCHEMBL6169068 | 0.88 | KEAP1 (0.49) | METAP2KEAP1NFE2L2SNCACCR2 | |
| SCHEMBL6171415 | 0.87 | KEAP1 (0.59) | KEAP1NFE2L2SNCAHTTALDH1A1 | |
| SCHEMBL6170544 | 0.87 | ERBB2 (0.55) | METAP2KEAP1NFE2L2SNCACCR2 | |
| SCHEMBL6171419 | 0.87 | KEAP1 (0.59) | KEAP1NFE2L2SNCAHTTALDH1A1 | |
| SCHEMBL6170538 | 0.87 | ERBB2 (0.55) | METAP2KEAP1NFE2L2SNCACCR2 | |
| SCHEMBL6170122 | 0.86 | SNCA (0.61) | KEAP1NFE2L2CYP2C9CYP2C19SNCA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1045833-B1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER (US) | 2005-11-02 | — | — | EP | disclosed |
| US-6608070-B1 | Useful for treatment of medical condition in which prostaglandins are implicated as pathogens | NAKAO KAZUNARI (JP) | 2003-08-19 | — | — | US | disclosed |
| CN-1284064-A | 2,3-substituted indole compounds as cox-2 inhibitors | PFIZER PHARMA (US) | 2001-02-14 | — | — | CN | disclosed |