Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8327803 | 0.72 | NPC1 (0.45) | NPC1DNM1LMNAKMT2AHTT | |
| SCHEMBL8327808 | 0.72 | NPC1 (0.45) | NPC1DNM1LMNACYP3A4CYP2D6 | |
| SCHEMBL8326197 | 0.68 | DNM1 (0.55) | NPC1DNM1LMNACYP3A4CYP2D6 | |
| SCHEMBL2915394 | 0.68 | DNM1 (0.55) | NPC1DNM1LMNACYP3A4CYP2D6 | |
| SCHEMBL155051 | 0.65 | TAAR1 (0.60) | LMNACYP3A4KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL6663240 | 0.64 | LMNA (0.59) | LMNACYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL170986 | 0.64 | LMNA (0.64) | NPC1DNM1LMNACYP3A4CYP2D6 | |
| SCHEMBL8622104 | 0.64 | SLC6A4 (0.44) | — | |
| Hydrochloric Acid SCHEMBL4710846 | 0.64 | LOXL2 (0.51) | NPC1DNM1LMNACYP2D6ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6252163 | 0.63 | KDM4E (0.58) | LMNACYP3A4L3MBTL1ALDH1A1CHRM2 |
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-5753654-A | GASTROINTESTINAL DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| US-5736550-A | TREATMENT OF GASTROINTESTINAL TRACT DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-04-07 | — | — | US | disclosed |