Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.65 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | FDPS | P14324 | 1/20 | 0.58 |
| ▸ | PDE4A | P27815 | 1/20 | 0.57 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.57 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | APP | P05067 | 3/20 | 0.57 |
| ▸ | TTR | P02766 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL161066 | 0.93 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL30873516 | 0.92 | PDCD1 (0.64) | ALDH1A1SMN1; SMN2PDCD1CD274MAPT | |
| SCHEMBL4944987 | 0.92 | PDCD1 (0.64) | ALDH1A1SMN1; SMN2PDCD1CD274MAPT | |
| SCHEMBL11331941 | 0.89 | PDCD1 (0.59) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL752160 | 0.88 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL29377794 | 0.88 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL6232167 | 0.87 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL13991619 | 0.86 | PDCD1 (0.68) | ALDH1A1PDCD1CD274HTTPDE4A | |
| SCHEMBL6444060 | 0.86 | PDCD1 (0.56) | ALDH1A1SMN1; SMN2PDCD1CD274HTT | |
| SCHEMBL30141008 | 0.86 | PDCD1 (0.56) | ALDH1A1SMN1; SMN2PDCD1CD274HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998008813-A1 | COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED PYRROLIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |