Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 0.69 |
| ▸ | PDE2A | O00408 | 1/20 | 0.67 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.65 |
| ▸ | PKLR | P30613 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | ESR1 | P03372 | 4/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | GLA | P06280 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | MAOA | P21397 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | MGAM | O43451 | 1/20 | 0.61 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| Iodomethane SCHEMBL8494114 | 0.94 | HSD17B3 (0.64) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL8493787 | 0.84 | PDE2A (0.56) | NQO1PDE2AHSD17B3PKLRKDM4E | |
| SCHEMBL31312649 | 0.83 | HSD17B3 (0.80) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL29738721 | 0.83 | NQO1 (0.63) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL3457273 | 0.83 | NQO1 (0.63) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| Hydrochloric Acid SCHEMBL14743958 | 0.82 | NQO1 (0.61) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL803408 | 0.80 | PDE2A (1.00) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL29401099 | 0.80 | PDE2A (1.00) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL16663940 | 0.80 | PDE2A (0.85) | NQO1PDE2AHSD17B3PKLRNPSR1 | |
| SCHEMBL29368885 | 0.80 | PDE2A (1.00) | NQO1PDE2AHSD17B3PKLRNPSR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8092086-A | — | — | None | — | — | JP | disclosed |
| EP-0598117-B1 | BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT | DAINIPPON INK & CHEMICALS (JP) | 1999-06-30 | — | — | EP | disclosed |
| JP-H0892086-A | MEDICINE FOR ATOPIC DERMATITIS | DAINIPPON INK & CHEM INC | 1996-04-09 | — | — | JP | disclosed |
| US-5428059-A | Benzopyran derivatives and an anti-allergic agent possessing the same as the active ingredient | DAINIPPON INK & CHEMICALS, INC. (JP) | 1995-06-27 | — | — | US | disclosed |
| EP-0598117-A1 | BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1994-05-25 | — | — | EP | disclosed |