Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1219721 | 0.81 | KDM4E (0.58) | KDM4EGAACLK4NPC1MAPT | |
| SCHEMBL9624152 | 0.81 | CLK4 (0.51) | KDM4EGAADYRK1ACLK4GRM5 | |
| Hydrochloric Acid SCHEMBL5427158 | 0.80 | ACHE (0.52) | DYRK1ACLK4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1219479 | 0.80 | KDM4E (0.60) | KDM4EGAAGRM5RAB9AACHE | |
| SCHEMBL197286 | 0.78 | ACHE (0.54) | DYRK1ACLK4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29635198 | 0.78 | ACHE (0.54) | DYRK1ACLK4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9333137 | 0.78 | KDM4E (0.63) | KDM4EGAACLK4NPC1MAPT | |
| SCHEMBL8030637 | 0.77 | CA4 (0.52) | NPC1RAB9ASMN1; SMN2MAOBACHE | |
| SCHEMBL6676480 | 0.77 | CA4 (0.52) | NPC1RAB9ASMN1; SMN2MAOBACHE | |
| SCHEMBL9624335 | 0.77 | CCR1 (0.48) | KDM4EGAADYRK1ACLK4NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0271144-B1 | PROCESS FOR THE CARBONYLATION OF ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-10-16 | — | — | EP | disclosed |
| EP-0271144-A2 | Process for the carbonylation of acetylenically unsaturated compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1988-06-15 | — | — | EP | disclosed |