Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | AGXT | P21549 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL12815569 | 0.98 | IDO1 (0.38) | IDO1DAOHTR6CYP1A2CYP2A6 | |
| SCHEMBL11554501 | 0.89 | ALDH1A1 (0.32) | KMT2AALDH1A1TDP1 | |
| SCHEMBL21494670 | 0.81 | IDO1 (0.34) | IDO1DAOHTR6CYP1A2CYP2A6 | |
| SCHEMBL7933390 | 0.80 | TAAR1 (0.39) | IDO1DAOHTR6TAAR1AGXT | |
| SCHEMBL2836936 | 0.79 | CALM1 (0.46) | CYP1A2TAAR1ALDH1A1LMNA | |
| SCHEMBL12815819 | 0.78 | IDH1 (0.34) | — | |
| SCHEMBL9143779 | 0.78 | CALM1 (0.44) | CYP1A2TAAR1LMNA | |
| SCHEMBL9144956 | 0.78 | CALM1 (0.44) | CYP1A2TAAR1LMNA | |
| SCHEMBL12814980 | 0.77 | ESR1 (0.38) | ALDH1A1HTTLMNA | |
| SCHEMBL12814968 | 0.77 | MGAM (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2028196-B1 | METHOD FOR PRODUCING POLYBUTADIENE | UBE INDUSTRIES (JP) | 2011-02-02 | — | — | EP | disclosed |
| EP-1249457-B1 | Method of producing a polymer | UBE INDUSTRIES (JP) | 2005-07-20 | — | — | EP | disclosed |
| US-6521726-B1 | Method of producing a polymer | UBE INDUSTRIES, LTD. (JP) | 2003-02-18 | — | — | US | disclosed |
| EP-1249457-A2 | Method of producing a polymer | Ube Industries, Ltd. (JP) | 2002-10-16 | — | — | EP | disclosed |