Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28083582 | 0.87 | ESR1 (0.37) | ESR1AOC3ALDH1A1KDM4ES1PR4 | |
| SCHEMBL4926772 | 0.79 | HDAC6 (0.44) | ESR1MCOLN3POLBS1PR4OPRM1 | |
| SCHEMBL28022660 | 0.77 | ALDH1A1 (0.38) | AOC3ALDH1A1POLBTSHRACHE | |
| SCHEMBL28879965 | 0.72 | CYP1A2 (0.39) | ALDH1A1POLBKDM4ETSHRLMNA | |
| SCHEMBL28022238 | 0.72 | TSHR (0.41) | ESR1MCOLN3ALDH1A1TSHRLMNA | |
| SCHEMBL21395985 | 0.71 | ESR1 (0.40) | ESR1ALDH1A1KDM4ES1PR4GAA | |
| SCHEMBL10770130 | 0.71 | TSHR (0.35) | ALDH1A1POLBKDM4ETP53TSHR | |
| Hydrochloric Acid SCHEMBL29687943 | 0.71 | CYP1A2 (0.38) | POLBTSHRLMNAACHE | |
| SCHEMBL23505092 | 0.70 | TSHR (0.39) | AOC3ALDH1A1KDM4ETSHRLMNA | |
| SCHEMBL11682887 | 0.70 | TSHR (0.39) | AOC3MCOLN3ALDH1A1POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6211178-B1 | ANTIPROTOZOA AGENTS FOR COCCIDIOIDES; CYCLIZATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-04-03 | — | — | US | disclosed |
| CN-1062861-C | Triazine derivatives, production and use thereof | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-03-07 | — | — | CN | disclosed |
| US-5994355-A | ANTIPROTOZOA AGENTS, PARASITICIDE; VETERINARY MEDICINE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-11-30 | — | — | US | disclosed |
| EP-0648760-B1 | Triazine derivative, production and use thereof | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-01-27 | — | — | EP | disclosed |
| CN-1106394-A | Triazine derivatives, production and use thereof | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1995-08-09 | — | — | CN | disclosed |
| EP-0648760-A2 | Triazine derivative, production and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-04-19 | — | — | EP | disclosed |