Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | GFER | P55789 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18157890 | 0.86 | CNR2 (0.44) | CNR2KMT2AENPP2ACHEEPHB4 | |
| SCHEMBL8027980 | 0.85 | ALDH1A1 (0.41) | ALDH1A1TDP1CNR2SMN1; SMN2GFER | |
| SCHEMBL11487823 | 0.84 | NPC1 (0.34) | ALDH1A1TDP1SMN1; SMN2GFERMAPT | |
| Hydrochloric Acid SCHEMBL906768 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TDP1CNR2SMN1; SMN2GFER | |
| Hydrochloric Acid SCHEMBL907030 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TDP1CNR2SMN1; SMN2GFER | |
| SCHEMBL11495012 | 0.81 | CCR4 (0.43) | ALDH1A1TDP1SMN1; SMN2GFERMAPT | |
| SCHEMBL10958555 | 0.81 | CNR2 (0.38) | ALDH1A1TDP1CNR2HPGDKMT2A | |
| SCHEMBL11318891 | 0.79 | — | — | |
| SCHEMBL19668321 | 0.78 | LOXL2 (0.44) | TDP1CNR2ENPP2ACHE | |
| SCHEMBL19668336 | 0.78 | CNR2 (0.36) | CNR2ENPP2ACHEBCHE |
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-4200578-A | ANTIULCER AGENTS, BLOCKING AGENTS, ANTISECRETORY AGENTS | BRISTOL-MYERS COMPANY (US) | 1980-04-29 | — | — | US | disclosed |