Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2667033 | 0.91 | CA1 (0.49) | CA1CA2MMP1MMP2MMP3 | |
| SCHEMBL2655696 | 0.80 | CA1 (0.47) | CA1CA2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2661179 | 0.76 | MAPT (0.41) | CA1CA2RAB9ASMN1; SMN2DPP4 | |
| SCHEMBL12879265 | 0.74 | CA1 (0.47) | CA1CA2NPC1RAB9APOLB | |
| SCHEMBL18828099 | 0.74 | CA1 (0.46) | CA1CA2MMP1MMP2MMP3 | |
| SCHEMBL3484035 | 0.72 | GAA (0.50) | HPGD | |
| SCHEMBL22858346 | 0.71 | ABCB11 (0.41) | MAPT | |
| SCHEMBL29975942 | 0.71 | NOTUM (0.55) | CA1CA2SMN1; SMN2MAPTKMT2A | |
| SCHEMBL1040017 | 0.71 | NOTUM (0.55) | CA1CA2SMN1; SMN2MAPTKMT2A | |
| SCHEMBL2661178 | 0.71 | L3MBTL1 (0.42) | NPC1RAB9ASMN1; SMN2DPP4MAPT |
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-101146762-A | Substituted aryl and heteroaryl derivatives | MERCK & CO INC (US) | 2008-03-19 | — | — | CN | disclosed |