Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9120456 | 0.98 | PTGS1 (0.57) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL7980862 | 0.79 | PTGS1 (0.47) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL4031415 | 0.79 | ALDH1A1 (0.53) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL8813974 | 0.76 | PTGS1 (0.49) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL3317159 | 0.75 | NPC1 (0.57) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL118449 | 0.74 | PTGS1 (1.00) | PTGS1PTGS2RAB9ANPC1MAPT | |
| SCHEMBL1733971 | 0.73 | NR4A2 (0.59) | ALDH1A1 | |
| Bromide SCHEMBL570786 | 0.72 | PTGS1 (0.96) | PTGS1PTGS2RAB9ANPC1MAPT | |
| Hydrochloric Acid SCHEMBL8878519 | 0.72 | PTGS1 (0.96) | PTGS1PTGS2RAB9ANPC1MAPT | |
| Water SCHEMBL21708935 | 0.72 | PTGS1 (0.96) | PTGS1PTGS2RAB9ANPC1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4990503-A | A bone resorption inhibitor | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1991-02-05 | — | — | US | disclosed |