Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.40 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.36 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1029075 | 0.74 | MAPT (0.59) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL27708571 | 0.74 | METAP2 (0.53) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL28106635 | 0.72 | SENP1 (0.56) | SENP1ESR1ESR2GAAMGAM | |
| SCHEMBL10553787 | 0.71 | SENP1 (0.48) | SENP1ESR1ESR2GAAMGAM | |
| SCHEMBL9186312 | 0.70 | CCR1 (0.61) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL31490208 | 0.70 | CCR1 (0.61) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL14843758 | 0.70 | RAB9A (0.61) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL20838492 | 0.69 | CCR1 (0.58) | CCR1RAB9ACCR5METAP2MAPT | |
| SCHEMBL28037982 | 0.68 | METAP2 (0.53) | CCR1RAB9ACCR5METAP2MAPT | |
| 8-Hydroxy Quinaldine SCHEMBL27650187 | 0.68 | METAP2 (0.72) | CCR1RAB9ACCR5METAP2ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101223162-A | Indolylmaleimide derivatives | NOVARTIS AG (CH) | 2008-07-16 | — | — | CN | disclosed |