Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11616243 | 0.86 | RAB9A (0.40) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11615852 | 0.85 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11614223 | 0.84 | KDM4E (0.47) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11616765 | 0.83 | KDM4E (0.36) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11617061 | 0.83 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11616351 | 0.82 | TNF (0.41) | ALDH1A1KDM4ETSHRHSD17B10NPSR1 | |
| SCHEMBL14536885 | 0.80 | RAB9A (0.57) | ALDH1A1SMN1; SMN2LMNAUSP2KDM4E | |
| SCHEMBL11616091 | 0.79 | TSHR (0.50) | ALDH1A1SMN1; SMN2KDM4ETSHRHSD17B10 | |
| SCHEMBL11616560 | 0.78 | KDM4E (0.36) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR | |
| SCHEMBL11617163 | 0.77 | KDM4E (0.39) | ALDH1A1SMN1; SMN2LMNAKDM4ETSHR |
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-4130649-A | Cyclohepta [B]pyridine-2-carboxylic acid derivatives | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-12-19 | — | — | US | claimed |
| US-4130557-A | DIOXANE AND/OR TETRAHYDROFURAN SOLVENT | SHIONOGI & CO., LTD. (JP) | 1978-12-19 | — | — | US | disclosed |
| US-4130649-A | Cyclohepta [B]pyridine-2-carboxylic acid derivatives | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-12-19 | — | — | US | disclosed |