Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ACACA | Q13085 | 3/20 | 0.40 |
| ▸ | FABP4 | P15090 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.38 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.37 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 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 | |
|---|---|---|---|---|
| SCHEMBL11560133 | 0.88 | PTGS1 (0.45) | ALDH1A1KDM4EACACAFABP4MAPT | |
| SCHEMBL11706034 | 0.84 | KDM4E (0.40) | ALDH1A1KDM4EALOX5FABP4MAPT | |
| SCHEMBL11703325 | 0.82 | HDAC8 (0.44) | ALDH1A1KDM4EFABP4MAPTPOLB | |
| SCHEMBL11705749 | 0.81 | ACACA (0.44) | ALDH1A1KDM4EACACAFABP4MAPT | |
| SCHEMBL31585801 | 0.80 | ACACA (0.41) | ALDH1A1KDM4EACACAHTTBCAT2 | |
| SCHEMBL11554193 | 0.79 | NR4A1 (0.44) | ALDH1A1KDM4EFABP4MAPTPOLB | |
| SCHEMBL11706498 | 0.79 | CA2 (0.39) | ALDH1A1FABP4MAPTPOLBPKM | |
| SCHEMBL11549033 | 0.79 | SMN1; SMN2 (0.49) | ALDH1A1KDM4EMAPTPOLBPKM | |
| SCHEMBL11703656 | 0.78 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTPKMHTT | |
| SCHEMBL11705281 | 0.78 | EGFR (0.38) | ALDH1A1KDM4EACACAFABP4POLB |
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-4013692-A | ANTIINFLAMMATORY, ANTIPYRETICS, ANALGESICS | RIKER LABORATORIES, INC. (US) | 1977-03-22 | — | — | US | disclosed |