Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAM | P19021 | 2/20 | 0.55 |
| ▸ | DGKA | P23743 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.38 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28213872 | 0.98 | PAM (0.59) | PAMDGKACYP1A2TSHRMAPT | |
| SCHEMBL2929543 | 0.94 | PAM (0.66) | PAMDGKATSHRMAPTTDP1 | |
| SCHEMBL28852385 | 0.91 | PAM (0.57) | PAMDGKACYP1A2TSHRMAPT | |
| SCHEMBL16907299 | 0.86 | ALDH1A1 (0.56) | PAMDGKACYP1A2TSHRMAPT | |
| SCHEMBL27516917 | 0.84 | PAM (0.59) | PAMDGKACYP1A2TSHRMAPT | |
| SCHEMBL3866745 | 0.82 | TDP1 (0.47) | PAMCYP1A2TDP1LMNAALDH1A1 | |
| SCHEMBL3004307 | 0.82 | PAM (0.74) | PAMDGKATSHRMAPTLMNA | |
| SCHEMBL1901901 | 0.82 | PAM (0.74) | PAMDGKATSHRMAPTLMNA | |
| SCHEMBL8041026 | 0.82 | PAM (0.74) | PAMDGKATSHRMAPTLMNA | |
| SCHEMBL3924509 | 0.82 | PAM (0.74) | PAMDGKATSHRMAPTLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4273781-A | Treatment of pain, fever, and inflammation with compositions containing piperidinobutan-and 3-buten-2-ones | MERCK & CO., INC. (US) | 1981-06-16 | — | — | US | disclosed |
| US-4250184-A | ANTIARTHRITIC AGENTS; SKIN DISORDERS; GOUT; RHEUMATIC DISEASES | MERCK & CO., INC. (US) | 1981-02-10 | — | — | US | disclosed |