Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 3/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 6/20 | 0.34 |
| ▸ | NCF1 | P14598 | 3/20 | 0.34 |
| ▸ | NCK1 | P16333 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 2/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL1765925 | 0.79 | BACE1 (0.48) | NOS2NOS3NOS1BACE1NCF1 | |
| SCHEMBL29414112 | 0.76 | NOS2 (0.50) | NOS2NOS3NOS1BACE1NCF1 | |
| SCHEMBL2901701 | 0.76 | NOS2 (0.50) | NOS2NOS3NOS1BACE1NCF1 | |
| SCHEMBL10665791 | 0.72 | HTR7 (0.49) | — | |
| SCHEMBL9376266 | 0.72 | KDM4E (0.44) | IDO1NOS2NOS3NOS1BACE1 | |
| SCHEMBL13701996 | 0.71 | — | — | |
| SCHEMBL6073481 | 0.71 | HASPIN (0.41) | NOS2NOS3NOS1BACE1NCF1 | |
| SCHEMBL10667360 | 0.70 | HTR7 (0.40) | NOS2NOS3NOS1KDM4EALDH1A1 | |
| SCHEMBL10754261 | 0.70 | RAB9A (0.50) | ALDH1A1LMNA | |
| SCHEMBL6412343 | 0.69 | PIK3CD (0.40) | IDO1NOS2NOS3NOS1BACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4960779-A | Pyrrole derivatives, and pharmaceutical compositions which contain them and pharmacological methods of use | RHONE-POULENC SANTE (FR) | 1990-10-02 | — | — | US | disclosed |
| US-4642308-A | ANTICONVULSANTS, ANXIOLYTIC AGENTS, ANTIEPILEPTIC AGENTS, HYPNOTICS, MUSCLE RELAXANTS | RHONE-POULENC SANTE (FR) | 1987-02-10 | — | — | US | disclosed |