Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9356623 | 0.86 | RAB9A (0.52) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9712276 | 0.85 | NPC1 (0.50) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9665289 | 0.84 | NPC1 (0.49) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9778461 | 0.79 | NPC1 (0.54) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL103357 | 0.79 | RAB9A (0.76) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9356416 | 0.78 | LDHA (0.49) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL23628928 | 0.76 | NPC1 (0.57) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9976049 | 0.76 | NPC1 (0.57) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL9778350 | 0.76 | RAB9A (0.57) | NPC1RAB9ACYP1A2CYP2C19RECQL | |
| SCHEMBL14803687 | 0.76 | RAB9A (0.48) | NPC1RAB9ACYP1A2CYP2C19RECQL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992018508-A1 | NEW CEPHEM COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-10-29 | — | — | WO | disclosed |