Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5201910 | 0.85 | NPC1 (0.42) | MAPTLMNANPC1RAB9AMEN1 | |
| SCHEMBL4858356 | 0.77 | CREBBP (0.42) | ALDH1A1HDAC1HDAC3HDAC2HDAC10 | |
| SCHEMBL4860164 | 0.73 | CNR2 (0.36) | MAPTKDM4ELMNATP53NPC1 | |
| SCHEMBL5205702 | 0.72 | CNR1 (0.37) | MAPTHRH2 | |
| SCHEMBL5203731 | 0.71 | PDE2A (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL6378962 | 0.70 | HRH2 (0.34) | MAPTKDM4ELMNATP53NPC1 | |
| SCHEMBL5206944 | 0.70 | RAB9A (0.55) | MAPTKDM4ELMNANPC1HPGD | |
| SCHEMBL4858050 | 0.68 | RAB9A (0.62) | MAPTKDM4ELMNATP53THRB | |
| SCHEMBL5202510 | 0.68 | HSD11B1 (0.55) | ALDH1A1KMT2ASMN1; SMN2HRH2 | |
| SCHEMBL5202293 | 0.67 | THRB (0.49) | MAPTKDM4ELMNATHRBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7368470-B2 | Substituted 3-pyrrolidine-indole derivatives | GRUENENTHAL GMBH (DE) | 2008-05-06 | — | — | US | disclosed |