Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 1/20 | 0.53 |
| ▸ | HTR1B | P28222 | 1/20 | 0.53 |
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.39 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6605603 | 0.88 | ALDH1A1 (0.52) | HTR1DHTR1BCCNCCDK8ALDH1A1 | |
| SCHEMBL8134923 | 0.78 | HPGD (0.50) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8143968 | 0.75 | ALDH1A1 (0.47) | ALDH1A1HPGDNPC1RAB9AKDM4E | |
| SCHEMBL8144130 | 0.75 | ATM (0.52) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL70006 | 0.75 | ALDH1A1 (0.69) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6102046 | 0.73 | EGFR (0.48) | ALDH1A1HPGDNPC1RAB9AKDM4E | |
| SCHEMBL8135917 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HPGDNPC1RAB9AKDM4E | |
| SCHEMBL8140899 | 0.73 | HPGD (0.47) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30643905 | 0.72 | SMN1; SMN2 (0.39) | CCNCCDK8ALDH1A1HPGDCNR2 | |
| SCHEMBL26643208 | 0.72 | SMN1; SMN2 (0.39) | CCNCCDK8ALDH1A1HPGDCNR2 |
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-6166034-A | Spiro piperidine derivatives as 5HT1D receptor antagonists | SMITHKLINE BEECHAM P. L. C (GB) | 2000-12-26 | — | — | US | disclosed |