Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 9/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7389576 | 0.78 | GRM5 (0.67) | GRM5NPC1RAB9ASMN1; SMN2CYP1A2 | |
| Hydrochloric Acid SCHEMBL7418874 | 0.77 | GRM5 (0.65) | GRM5NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL15014176 | 0.70 | CYP1A1 (0.64) | GRM5NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL10060646 | 0.70 | L3MBTL1 (0.61) | GRM5NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL5886608 | 0.70 | APP (0.71) | GRM5NPC1SMN1; SMN2CYP1A2KDM4E | |
| SCHEMBL13377842 | 0.69 | GRM5 (0.57) | GRM5NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL27430949 | 0.68 | ADORA2A (0.52) | NPC1RAB9ASMN1; SMN2CYP1A2KDM4E | |
| Methane SCHEMBL28739770 | 0.68 | APP (0.67) | GRM5NPC1SMN1; SMN2CYP1A2KDM4E | |
| SCHEMBL14970094 | 0.67 | TSHR (0.56) | NPC1RAB9ASMN1; SMN2KDM4EMEN1 | |
| SCHEMBL5949303 | 0.67 | APP (0.75) | GRM5NPC1SMN1; SMN2CYP1A2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214303-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | Merck & Co., Inc. (US) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001016121-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | MERCK & CO., INC. (US) | 2001-03-08 | — | — | WO | disclosed |