Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | MC4R | P32245 | 5/20 | 0.46 |
| ▸ | MC5R | P33032 | 4/20 | 0.46 |
| ▸ | MC3R | P41968 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7327297 | 0.90 | BCHE (0.48) | ALDH1A1LMNAMAPTSMN1; SMN2BCHE | |
| SCHEMBL7329410 | 0.88 | SLC6A4 (0.50) | ALDH1A1LMNAMAPTSMN1; SMN2BCHE | |
| SCHEMBL7332251 | 0.88 | ALDH1A1 (0.45) | ALDH1A1LMNAMAPTSMN1; SMN2KDM4E | |
| SCHEMBL7324350 | 0.87 | MC4R (0.48) | ALDH1A1LMNAMAPTSMN1; SMN2BCHE | |
| SCHEMBL7332178 | 0.86 | MC4R (0.47) | ALDH1A1LMNAMAPTSMN1; SMN2BCHE | |
| SCHEMBL7336174 | 0.82 | HTR1A (0.47) | LMNACYP3A4CYP2D6TSHRBCHE | |
| SCHEMBL7328589 | 0.81 | HTR1A (0.43) | MC4RMC5RMC3RHTR1AHTR7 | |
| SCHEMBL7330079 | 0.80 | MC4R (0.47) | BCHEMC4RMC5RMC3RSLC6A4 | |
| SCHEMBL7325675 | 0.79 | MC4R (0.47) | MC4RMC5RMC3RHTR1AHTR7 | |
| SCHEMBL7333675 | 0.79 | DRD2 (0.47) | MC4RMC5RMC3R |
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 |
|---|---|---|---|---|---|---|---|
| EP-0402923-A2 | 2,5-Diaminotetralines, process for their preparation and their use as medicine | BOEHRINGER INGELHEIM KG (DE) | 1990-12-19 | — | — | EP | disclosed |