Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL119711 | 0.89 | TRPV6 (0.39) | MGLLCA1CA2 | |
| SCHEMBL6609673 | 0.86 | ESR1 (0.38) | MGLLCA1CA2MMP3BCL2L1 | |
| SCHEMBL14830420 | 0.85 | MGLL (0.51) | MGLLCA1CA2 | |
| SCHEMBL16334163 | 0.83 | KIF11 (0.42) | MAPTLMNASMN1; SMN2 | |
| SCHEMBL16752320 | 0.83 | CA1 (0.53) | CA1CA2LMNANPC1SMN1; SMN2 | |
| SCHEMBL1774449 | 0.82 | LTA4H (0.40) | MGLLCYP2C9LMNASMN1; SMN2HTT | |
| SCHEMBL14830736 | 0.82 | ALDH1A1 (0.41) | CYP2C9MAPTLMNACASP3SENP7 | |
| SCHEMBL6607206 | 0.82 | PPARG (0.34) | — | |
| SCHEMBL15391292 | 0.82 | ALDH1A1 (0.35) | MGLLCA1CA2CYP2C9MAPT | |
| SCHEMBL19433226 | 0.82 | CA2 (0.42) | MGLLCA1CA2TRPV1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2209788-B1 | PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE | BASF SE (DE) | 2013-09-04 | — | — | EP | disclosed |