Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 3/20 | 0.34 |
| ▸ | DRD3 | P35462 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7965447 | 0.85 | HRH3 (0.36) | DRD3POLBMAPK1HTTSMN1; SMN2 | |
| SCHEMBL7963097 | 0.84 | HRH3 (0.36) | ALDH1A1KMT2ALMNAMEN1POLB | |
| Malonic Acid SCHEMBL7953257 | 0.82 | TP53 (0.36) | ALDH1A1KMT2ALMNAMEN1ITGA4 | |
| SCHEMBL7962994 | 0.82 | DRD2 (0.38) | OPRM1OPRD1OPRK1OPRL1DRD3 | |
| SCHEMBL7967089 | 0.79 | TUBB4A (0.39) | ALDH1A1LMNATSHRMAPK1SMN1; SMN2 | |
| Succinic Acid SCHEMBL7965776 | 0.78 | ITGA4 (0.34) | KMT2AOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL7967120 | 0.76 | ABCB1 (0.41) | ITGA4ITGB7DRD3DRD2 | |
| SCHEMBL7965338 | 0.74 | OPRM1 (0.31) | OPRM1OPRD1OPRK1OPRL1DRD3 | |
| SCHEMBL7953971 | 0.73 | OPRM1 (0.33) | OPRM1OPRD1OPRK1OPRL1ITGA4 | |
| SCHEMBL7965737 | 0.73 | HTR1A (0.41) | DRD3DRD2 |
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 |