Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5695679 | 1.00 | SLC6A3 (0.47) | SLC6A3HDAC1HDAC2CHRM1AKR1A1 | |
| SCHEMBL5695682 | 0.87 | TSHR (0.46) | HDAC1HDAC2TSHRGPR139KMT2A | |
| SCHEMBL5695680 | 0.87 | TSHR (0.46) | HDAC1HDAC2TSHRGPR139KMT2A | |
| SCHEMBL9814713 | 0.84 | CPA3 (0.54) | TSHRGPR139CYP1A2ALDH1A1 | |
| SCHEMBL6576344 | 0.83 | CYP1A2 (0.44) | TSHRKMT2AGRIK1CYP1A2MEN1 | |
| SCHEMBL6576342 | 0.83 | CYP1A2 (0.44) | TSHRKMT2AGRIK1CYP1A2MEN1 | |
| SCHEMBL6162834 | 0.81 | GPR139 (0.46) | TSHRGPR139KMT2AACESLC1A3 | |
| SCHEMBL10647041 | 0.79 | TSHR (0.68) | TDP1TSHRGPR139KMT2ACES1 | |
| SCHEMBL6209557 | 0.79 | CYP1A2 (0.61) | SLC1A3SLC1A2SLC1A1CYP1A2MME | |
| SCHEMBL6169492 | 0.79 | CYP1A2 (0.61) | SLC1A3SLC1A2SLC1A1CYP1A2MME |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0947502-B1 | NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES | SANTEN PHARMACEUTICAL CO LTD (JP) | 2006-06-21 | — | — | EP | disclosed |
| EP-0870762-B1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO LTD (JP) | 2004-04-28 | — | — | EP | disclosed |
| US-6046235-A | SULFUR-CONTAINING AMINO ACID DERIVATIVES WHICH HAVE INHIBITORY EFFECTS ON LEUKOTRIENE A4 HYDROLASE AND USEFUL AS THERAPEUTICAL AGENTS FOR INFLAMMATORY DISEASES SUCH AS RHEUMATISM, PSORIASIS, GOUT, CYSTIC FIBROSIS AND BOWL DISEASES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2000-04-04 | — | — | US | disclosed |
| EP-0947502-A1 | NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1999-10-06 | — | — | EP | disclosed |
| US-5872281-A | COMPOUNDS FOR TREATMENT OF RHEUMATIC DISEASES, PSORIASIS, INTESTINAL INFLAMATION | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1999-02-16 | — | — | US | disclosed |
| EP-0870762-A1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1998-10-14 | — | — | EP | disclosed |