Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 3/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 4/20 | 0.32 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GRM8 | O00222 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19782389 | 0.73 | DHODH (0.38) | GRM4NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL19782392 | 0.68 | DHODH (0.40) | NPC1RAB9ASMN1; SMN2MEN1MAPT | |
| SCHEMBL15993253 | 0.64 | KDR (0.45) | GRM4KDRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19783003 | 0.63 | ADORA3 (0.41) | KDRTRPV4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18612506 | 0.62 | KDR (0.40) | GRM4KDRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19782384 | 0.61 | ALDH1A1 (0.38) | KDRNPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL15993389 | 0.58 | GRM4 (0.48) | GRM4KDRTRPV4NPC1RAB9A | |
| SCHEMBL15993076 | 0.58 | NPC1 (0.48) | TRPV4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL370278 | 0.58 | GRM4 (0.77) | GRM4KDRKCNH2TRPV4NPC1 | |
| SCHEMBL15999193 | 0.57 | ALDH1A1 (0.53) | NPC1RAB9ASMN1; SMN2MEN1MAPT |
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-2018013508-A1 | SUBSTITUTED AMINOTHIAZOLES | BARUCH S. BLUMBERG INSTITUTE (US) | 2018-01-18 | — | — | WO | disclosed |