Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPD | P32754 | 4/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | HSPB1 | P04792 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | MGMT | P16455 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19699785 | 0.84 | CYP19A1 (0.45) | NPC1RAB9ARECQLTDP1MAPT | |
| SCHEMBL18122105 | 0.83 | GRIN2D (0.45) | NPC1RAB9ARECQLTDP1MAPT | |
| SCHEMBL30870635 | 0.83 | NPC1 (0.46) | NPC1RAB9ARECQLTDP1MAPT | |
| SCHEMBL2060423 | 0.83 | NPC1 (0.46) | NPC1RAB9ARECQLTDP1MAPT | |
| SCHEMBL13476249 | 0.81 | ALDH1A1 (0.55) | NPC1RAB9ARECQLTSHRTDP1 | |
| SCHEMBL27693986 | 0.81 | L3MBTL1 (0.47) | NPC1RAB9ARECQLTDP1MAPT | |
| SCHEMBL31357841 | 0.81 | KDM4E (0.43) | NPC1RAB9ARECQLMAPTSMN1; SMN2 | |
| SCHEMBL20982463 | 0.80 | KDM4E (0.52) | NPC1RAB9ARECQLMAPTSMN1; SMN2 | |
| SCHEMBL19706976 | 0.80 | NPC1 (0.43) | NPC1RAB9ARECQLMAPTSMN1; SMN2 | |
| SCHEMBL25293041 | 0.78 | MAPT (0.44) | NPC1RAB9ARECQLTDP1MAPT |
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-5071468-A | Cereal selectivity | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1991-12-10 | — | — | US | disclosed |
| EP-0375076-A1 | Heterocyclic herbicides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-06-27 | — | — | EP | disclosed |