Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 4/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | CASP9 | P55211 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL9263852 | 0.85 | PHOSPHO1 (0.47) | KDM4EMAPTPKMHSD17B10TDP1 | |
| SCHEMBL9262493 | 0.81 | MAPT (0.46) | KDM4EMAPTPKMTDP1SMN1; SMN2 | |
| SCHEMBL9258084 | 0.78 | ALDH1A1 (0.43) | KDM4EMAPTPKMLMNAKAT2B | |
| SCHEMBL9265563 | 0.77 | KDM4E (0.40) | KDM4EMAPTPKMLMNARXFP1 | |
| SCHEMBL9256085 | 0.75 | PMM2 (0.45) | KDM4EMAPTPKMHSD17B10TDP1 | |
| SCHEMBL9263510 | 0.75 | SMN1; SMN2 (0.60) | KDM4EMAPTLMNAHSD17B10TDP1 | |
| SCHEMBL9260520 | 0.71 | NR1H3 (0.33) | KAT2B | |
| SCHEMBL8080054 | 0.70 | HSD17B10 (0.41) | KDM4EMAPTPKMLMNAHSD17B10 | |
| SCHEMBL9265797 | 0.69 | MYC (0.45) | KDM4EMAPTTDP1RAB9AALDH1A1 | |
| SCHEMBL9256371 | 0.67 | ALDH1A1 (0.42) | MAPTLMNACYP3A4TDP1SMN1; SMN2 |
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-5411977-A | Substituted 2,5-diaryl-4-isothiazolin-3-ones as antiinflammatory and antithrombotic agents | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-05-02 | — | — | US | disclosed |