Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.43 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.43 |
| ▸ | DBH | P09172 | 1/20 | 0.43 |
| ▸ | YES1 | P07947 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL6085083 | 0.84 | HTR6 (0.44) | KMT2AMAPTHTR6TP53POLB | |
| SCHEMBL9056875 | 0.84 | HTR6 (0.55) | HTR6LMNATP53POLB | |
| SCHEMBL8389282 | 0.82 | HTR6 (0.48) | HTR6TP53POLBPPARG | |
| SCHEMBL8388912 | 0.81 | CNR1 (0.45) | KMT2AALDH1A1SMN1; SMN2MAPTHTR6 | |
| SCHEMBL5119197 | 0.80 | RECQL (0.42) | KMT2AALDH1A1MAPTRECQLMEN1 | |
| SCHEMBL5422616 | 0.80 | ALDH1A1 (0.49) | KMT2AALDH1A1SMN1; SMN2MAPTPAX8 | |
| SCHEMBL8688207 | 0.77 | ALDH1A1 (0.71) | KMT2AALDH1A1SMN1; SMN2MAPTPAX8 | |
| SCHEMBL27657208 | 0.75 | HDAC8 (0.48) | ALDH1A1SMN1; SMN2DBHMAOAMAOB | |
| SCHEMBL27095359 | 0.73 | HTR2C (0.41) | KMT2AALDH1A1MAPTMEN1PPARG | |
| SCHEMBL8387016 | 0.73 | MPO (0.47) | MAPTHTR6MAOBPPARG |
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-1882537-A | Substituted indolecarboxylic acid derivatives and their use as PAI-1 inhibitors | WYETH CORP (US) | 2006-12-20 | — | — | CN | disclosed |