Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.40 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16958480 | 0.84 | NPC1 (0.42) | NPC1RAB9ALMNAMAPTSMN1; SMN2 | |
| SCHEMBL11362731 | 0.82 | ERN1 (0.56) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL16957312 | 0.82 | SMN1; SMN2 (0.44) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL16958372 | 0.81 | MEN1 (0.43) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL16961062 | 0.81 | VEGFA (0.39) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL4739158 | 0.80 | RAB9A (0.59) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL16959979 | 0.80 | ALDH1A1 (0.41) | LMNAMAPTCYP2C9KMT2AKDM4E | |
| SCHEMBL16955705 | 0.79 | ALDH1A1 (0.38) | NPC1RAB9ALMNAMAPTCYP2C9 | |
| SCHEMBL16954004 | 0.78 | POLB (0.33) | NPC1RAB9AMAPTSMN1; SMN2POLB | |
| SCHEMBL16952970 | 0.78 | SLC22A12 (0.38) | KMT2AKDM4EADORA2AADORA1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |