Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.62 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.51 |
| ▸ | CHKA | P35790 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | INSR | P06213 | 1/20 | 0.50 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5679807 | 0.95 | KDM4E (0.61) | TGFBR1ACVR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL7236258 | 0.90 | TGFBR1 (0.54) | TGFBR1ACVR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL5572636 | 0.86 | POLB (0.76) | KDM4EMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL4773743 | 0.86 | TGFBR1 (0.53) | TGFBR1ACVR1KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5572656 | 0.85 | POLB (0.74) | KDM4EMEN1ALDH1A1KMT2ALMNA | |
| SCHEMBL5681800 | 0.83 | DRD4 (0.62) | KDM4EMEN1ALDH1A1KMT2ATDP1 | |
| Hydrochloric Acid SCHEMBL10334149 | 0.81 | KDM4E (0.75) | KDM4EMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL5683255 | 0.80 | DRD4 (0.58) | KDM4EMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL5683636 | 0.80 | TGFBR1 (0.55) | TGFBR1ACVR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL4108344 | 0.80 | CA12 (0.51) | KDM4EMEN1ALDH1A1KMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1403249-A1 | CYCLIC DIAMINE COMPOUNDS BEARING SIX-MEMBERED CYCLIC GROUPS | Kowa Co., Ltd. (JP) | 2004-03-31 | — | — | EP | disclosed |