Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | STAT3 | P40763 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 4/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8940508 | 1.00 | TSHR (0.58) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL8844963 | 0.86 | TSHR (0.60) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL14830246 | 0.86 | TSHR (0.60) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL14830221 | 0.86 | TSHR (0.60) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL8940495 | 0.86 | TSHR (0.60) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL2029904 | 0.79 | TSHR (0.56) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL2029906 | 0.79 | TSHR (0.56) | TSHRHTTALDH1A1LMNASTAT3 | |
| SCHEMBL318036 | 0.78 | CA2 (0.68) | ALDH1A1STAT3CA2KDM4EMEN1 | |
| SCHEMBL29475007 | 0.78 | CA2 (0.68) | ALDH1A1STAT3CA2KDM4EMEN1 | |
| SCHEMBL13576478 | 0.77 | TSHR (0.77) | TSHRHTTALDH1A1LMNASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0654995-B1 | 4-OXA-1-AZABICYCLO (3,2,0) HEPTAN-7-ONE DERIVATIVES AS ANTITUMOR AGENTS | TAIHO PHARMACEUTICAL CO LTD (JP) | 1996-10-23 | — | — | EP | disclosed |
| US-5561126-A | OXAPENAMS HAVING CHEMICAL STABILITY; ANTICARCINOGENIC AGENTS; LEUKEMIA | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 1996-10-01 | — | — | US | disclosed |
| WO-1994001109-A1 | 4-OXA-1-AZABICYCLO [3,2,0] HEPTAN-7-ONE DERIVATIVES AS ANTITUMOR AGENTS | TAIHO PHARMACEUTICAL CO. LTD. (JP) | 1994-01-20 | — | — | WO | disclosed |