Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | GCGR | P47871 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7966080 | 0.86 | KDM4E (0.54) | KDM4ESMN1; SMN2ALDH1A1GCGRHRH1 | |
| SCHEMBL7966533 | 0.79 | KDM4E (0.47) | KDM4ESMN1; SMN2ALDH1A1DRD3MMP1 | |
| SCHEMBL7962445 | 0.67 | HTR1A (0.42) | DRD3HTR1AHTR2AHRH3MEN1 | |
| Oxalic Acid SCHEMBL7966526 | 0.67 | KDM4E (0.54) | KDM4ESMN1; SMN2ALDH1A1DRD3HTR1A | |
| SCHEMBL7033807 | 0.67 | HTR1A (0.80) | KDM4ESMN1; SMN2ALDH1A1DRD3HTR1A | |
| Oxalic Acid SCHEMBL5856230 | 0.67 | KDM4E (1.00) | KDM4ESMN1; SMN2ALDH1A1HRH1NPC1 | |
| SCHEMBL11717047 | 0.66 | ALDH1A1 (0.74) | KDM4ESMN1; SMN2ALDH1A1DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL29427652 | 0.66 | DRD3 (0.68) | KDM4ESMN1; SMN2ALDH1A1DRD3DRD2 | |
| SCHEMBL7962754 | 0.66 | ALDH1A1 (0.56) | KDM4ESMN1; SMN2ALDH1A1DRD3HTR1A | |
| SCHEMBL15349833 | 0.66 | KDM4E (0.70) | KDM4ESMN1; SMN2ALDH1A1DRD3HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |