Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GUSB | P08236 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10486239 | 0.87 | DHFR (0.44) | DHFRALDH1A1SMN1; SMN2AGPAT2NPSR1 | |
| SCHEMBL9566557 | 0.85 | CYP1A2 (0.56) | DHFRALDH1A1SMN1; SMN2MAOBTLR8 | |
| SCHEMBL10486284 | 0.83 | SMN1; SMN2 (0.49) | DHFRALDH1A1SMN1; SMN2MAOBKDM4E | |
| SCHEMBL27612369 | 0.81 | DHFR (0.60) | DHFRALDH1A1NPSR1TTRMAOB | |
| SCHEMBL3678540 | 0.80 | HSP90AA1 (0.58) | DHFRALDH1A1SMN1; SMN2KDM4EADORA2A | |
| SCHEMBL9566443 | 0.80 | BRD4 (0.57) | DHFRSMN1; SMN2TLR8PDE5AL3MBTL1 | |
| SCHEMBL26105184 | 0.80 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2NPSR1TTRKDM4E | |
| SCHEMBL10486211 | 0.79 | LMNA (0.49) | ALDH1A1SMN1; SMN2AGPAT2NPSR1KDM4E | |
| SCHEMBL14529381 | 0.79 | DHFR (0.57) | DHFRALDH1A1SMN1; SMN2TLR8KDM4E | |
| SCHEMBL28185277 | 0.78 | PDE5A (0.53) | ALDH1A1SMN1; SMN2NPSR1TTRKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4873242-A | NOOTROPIC AGENTS | NIPPON SHINYAKU CO., LTD. (JP) | 1989-10-10 | — | — | US | claimed |
| EP-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-4873242-A | NOOTROPIC AGENTS | NIPPON SHINYAKU CO., LTD. (JP) | 1989-10-10 | — | — | US | disclosed |