Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 10/20 | 0.43 |
| ▸ | PIM1 | P11309 | 10/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.40 |
| ▸ | CDK2 | P24941 | 3/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9877170 | 0.83 | NTRK1 (0.64) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9877172 | 0.83 | NTRK1 (0.64) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9728870 | 0.81 | NTRK1 (0.65) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9878320 | 0.81 | KDM4E (0.48) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9728647 | 0.81 | KDM4E (0.48) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9728729 | 0.79 | NTRK1 (0.53) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9877954 | 0.69 | MAPT (0.53) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL9877951 | 0.69 | MAPT (0.53) | NTRK1PIM1CHEK1CDK2CSNK2A1 | |
| SCHEMBL11465849 | 0.64 | BRAF (0.59) | MAPTNPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL9877207 | 0.63 | KDM4E (0.67) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5059691-A | Anxiolytic agents; hypotensive agents; nervous system disorders; cognition activators | AMERICAN CYANAMID COMPANY (US) | 1991-10-22 | — | — | US | disclosed |