Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.60 |
| ▸ | CCR2 | P41597 | 4/20 | 0.58 |
| ▸ | DAO | P14920 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | BCL2 | P10415 | 1/20 | 0.46 |
| ▸ | BID | P55957 | 1/20 | 0.46 |
| ▸ | NOD2 | Q9HC29 | 3/20 | 0.45 |
| ▸ | NOD1 | Q9Y239 | 3/20 | 0.45 |
| ▸ | LDHA | P00338 | 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 | |
|---|---|---|---|---|
| SCHEMBL2182148 | 0.85 | PLA2G10 (0.50) | MCL1CCR2DAOALDH1A1TSHR | |
| SCHEMBL6685154 | 0.84 | MCL1 (0.57) | MCL1CCR2DAOALDH1A1TSHR | |
| SCHEMBL26967654 | 0.83 | MCL1 (0.55) | MCL1CCR2DAOALDH1A1TSHR | |
| SCHEMBL31599460 | 0.82 | CCR2 (0.72) | MCL1CCR2DAOALDH1A1TSHR | |
| SCHEMBL4121234 | 0.82 | CCR2 (0.72) | MCL1CCR2DAOALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL4119324 | 0.81 | CCR2 (0.71) | MCL1CCR2DAOALDH1A1TSHR | |
| SCHEMBL4375022 | 0.80 | ACLY (0.61) | CCR2 | |
| SCHEMBL6674180 | 0.79 | NOD2 (0.71) | MCL1ALDH1A1TSHRAGTR1LMNA | |
| SCHEMBL16794402 | 0.79 | NOD1 (0.71) | MCL1CCR2DAOALDH1A1AGTR1 | |
| SCHEMBL4369364 | 0.77 | KDM4E (0.65) | CCR2ALDH1A1TSHRCYP1A2POLB |
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-1018878-A4 | NOVEL INDOLECARBOXAMIDES, PHARMACEUTICAL COMPOSITIONS AND METHODSOF INHIBITING CALPAIN | SMITHKLINE BEECHAM CORP (US) | 2001-01-10 | — | — | EP | disclosed |
| EP-1018878-A1 | NOVEL INDOLECARBOXAMIDES, PHARMACEUTICAL COMPOSITIONS AND METHODSOF INHIBITING CALPAIN | SmithKline Beecham Corporation (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998041092-A1 | NOVEL INDOLECARBOXAMIDES, PHARMACEUTICAL COMPOSITIONS AND METHODSOF INHIBITING CALPAIN | SMITHKLINE BEECHAM CORPORATION (US) | 1998-09-24 | — | — | WO | disclosed |