Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10207671 | 0.85 | EGFR (0.48) | SRCGABRA2GABRB2LMNAEGFR | |
| SCHEMBL12309511 | 0.85 | — | — | |
| SCHEMBL2737105 | 0.83 | CA12 (0.51) | CA12CA1CA2CA9CA7 | |
| SCHEMBL2737123 | 0.80 | HPGD (0.57) | CHRNA7CA1CA2SRCLCK | |
| SCHEMBL13594234 | 0.79 | HDAC1 (0.48) | SRCEGFRKDRALDH1A1TSHR | |
| SCHEMBL2736511 | 0.79 | HPGD (0.47) | CA12CA1CA2CA9CA7 | |
| SCHEMBL2736546 | 0.78 | LMNA (0.44) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL2737111 | 0.76 | MAPT (0.49) | SRCLMNAEGFRKDRHPGD | |
| SCHEMBL2737112 | 0.75 | TDP1 (0.47) | GABRA2LMNAHPGDSMN1; SMN2TDP1 | |
| SCHEMBL2736681 | 0.74 | SMN1; SMN2 (0.46) | LMNACYP1A2CYP3A4MAOAALDH1A1 |
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-2402314-A1 | (Aza)indole derivative and use thereof for medical purposes | Kissei Pharmaceutical Co., Ltd. (JP) | 2012-01-04 | — | — | EP | disclosed |