Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31083232 | 0.74 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL9839089 | 0.74 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL16080089 | 0.73 | RAB9A (0.58) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL3727157 | 0.73 | MEN1 (0.72) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL9820532 | 0.70 | MGAM (0.50) | NPC1RAB9ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL12787954 | 0.66 | RAB9A (0.52) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL28758405 | 0.66 | MAPT (0.49) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL14966349 | 0.65 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL9664681 | 0.65 | ALDH1A1 (0.39) | ALDH1A1KMT2A | |
| SCHEMBL16080088 | 0.64 | RAB9A (0.62) | NPC1RAB9ASMN1; SMN2ALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5013745-A | Mercapto-1,3,4-oxadiazole or thiadiazole derivatives | CIBA-GEIGY CORPORATION (US) | 1991-05-07 | — | — | US | claimed |
| EP-0364395-A1 | Nematicides | CIBA-GEIGY AG (CH) | 1990-04-18 | — | — | EP | claimed |
| US-5013745-A | Mercapto-1,3,4-oxadiazole or thiadiazole derivatives | CIBA-GEIGY CORPORATION (US) | 1991-05-07 | — | — | US | disclosed |
| EP-0364395-A1 | Nematicides | CIBA-GEIGY AG (CH) | 1990-04-18 | — | — | EP | disclosed |