Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 4/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 3/20 | 0.31 |
| ▸ | RXRB | P28702 | 3/20 | 0.31 |
| ▸ | RXRG | P48443 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7953681 | 0.86 | ADRB2 (0.34) | ADRB2ADRB1CYP1A2HIF1AADRA2A | |
| SCHEMBL7963395 | 0.82 | LMNA (0.44) | ADRB2ADRB1CYP1A2HIF1AADRA2A | |
| SCHEMBL7963401 | 0.81 | ADRB2 (0.33) | ADRB2ADRB1CYP1A2HIF1AADRA2A | |
| SCHEMBL7965112 | 0.80 | LMNA (0.39) | CYP1A2KDM4ETP53CYP2D6TSHR | |
| Fumaric Acid SCHEMBL7966209 | 0.79 | MAPT (0.38) | MEN1LMNAKMT2ANPSR1HCRTR1 | |
| Fumaric Acid SCHEMBL7966218 | 0.79 | MAPT (0.38) | MEN1LMNAKMT2ANPSR1HCRTR1 | |
| SCHEMBL7962207 | 0.78 | ALDH1A1 (0.43) | KDM4ETP53TSHRMEN1LMNA | |
| SCHEMBL7962696 | 0.78 | LTA4H (0.35) | KDM4EMEN1LMNAKMT2AOPRM1 | |
| SCHEMBL7964944 | 0.77 | MEN1 (0.30) | MEN1KMT2A | |
| Salicylic Acid SCHEMBL8133872 | 0.76 | ABCB1 (0.32) | KDM4ELMNAHCRTR1HCRTR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6242450-B1 | SUBSTITUTED PIPERIDINES | ELI LILLY AND COMPANY | 2001-06-05 | — | — | US | disclosed |
| WO-2000006166-A1 | 5-HT1F ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2000-02-10 | — | — | WO | disclosed |
| EP-0976746-A1 | 5-HT1F antagonists | ELI LILLY AND COMPANY (US) | 2000-02-02 | — | — | EP | disclosed |