Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.36 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.36 |
| ▸ | ITGAL | P20701 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ACE | P12821 | 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 | |
|---|---|---|---|---|
| SCHEMBL10954717 | 1.00 | ALDH1A1 (0.40) | ALDH1A1MAPTL3MBTL1MCL1ITGB3 | |
| SCHEMBL10954720 | 1.00 | ALDH1A1 (0.40) | ALDH1A1MAPTL3MBTL1MCL1ITGB3 | |
| SCHEMBL10951128 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTL3MBTL1TSHRGAA | |
| SCHEMBL10951130 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTL3MBTL1TSHRGAA | |
| SCHEMBL10949784 | 0.78 | NPC1 (0.44) | ALDH1A1MAPTL3MBTL1TSHRBRD4 | |
| SCHEMBL10952057 | 0.78 | NPC1 (0.44) | ALDH1A1MAPTL3MBTL1TSHRBRD4 | |
| SCHEMBL10949780 | 0.78 | NPC1 (0.44) | ALDH1A1MAPTL3MBTL1TSHRBRD4 | |
| SCHEMBL11398697 | 0.76 | MEN1 (0.59) | ALDH1A1MAPTBRD4CREBBPGAA | |
| SCHEMBL11398705 | 0.76 | MEN1 (0.59) | ALDH1A1MAPTBRD4CREBBPGAA | |
| SCHEMBL9203598 | 0.75 | MTNR1A (0.36) | ALDH1A1DDB1CRBNACENFKB1 |
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-1994003168-A1 | 5 S PENEM DERIVATIVES, THEIR PREPARATION AND USE | SMITHKLINE BEECHAM PLC (GB) | 1994-02-17 | — | — | WO | disclosed |