Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 10/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 7/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | AGER | Q15109 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7965525 | 0.86 | OPRL1 (0.35) | ABCB1HTR1ADRD2OPRM1DRD3 | |
| SCHEMBL7965521 | 0.84 | HCRTR1 (0.34) | ABCB1MAPTAGERLMNAKDM4E | |
| SCHEMBL7953962 | 0.84 | ABCB1 (0.54) | ABCB1CYP1A2CYP2C19MAPTTDP1 | |
| SCHEMBL7966028 | 0.83 | ABCB1 (0.54) | ABCB1MAPTMEN1KMT2ALMNA | |
| SCHEMBL7953389 | 0.82 | HTR1A (0.53) | ABCB1HTR1AADRA2ASLC6A2SLC6A4 | |
| SCHEMBL7962648 | 0.82 | ABCB1 (0.47) | ABCB1CYP1A2CYP2C19MAPTTDP1 | |
| SCHEMBL7968243 | 0.82 | CYP1A2 (0.47) | ABCB1CYP1A2CYP2C19MAPTTDP1 | |
| SCHEMBL7953370 | 0.82 | HTR1A (0.56) | ADRB1HTR1ASLC6A4 | |
| SCHEMBL7968936 | 0.81 | ABCB1 (0.52) | ABCB1CYP1A2CYP2C19MAPTTDP1 | |
| SCHEMBL7965363 | 0.80 | PRMT5 (0.48) | ABCB1CYP1A2CYP2C19MAPTTDP1 |
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 |
| EP-0976746-A1 | 5-HT1F antagonists | ELI LILLY AND COMPANY (US) | 2000-02-02 | — | — | EP | disclosed |
| EP-0976747-A2 | Use of 5HT-1F receptor antagonists for treating anxiety disorders | ELI LILLY AND COMPANY (US) | 2000-02-02 | — | — | EP | disclosed |