Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.59 |
| ▸ | KCNJ1 | P48048 | 4/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.55 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3292782 | 0.93 | TSHR (0.75) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL44366 | 0.93 | POLB (0.76) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL8087428 | 0.93 | POLB (0.76) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL8094050 | 0.93 | POLB (0.76) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL8096572 | 0.90 | POLB (0.61) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL3887887 | 0.88 | TSHR (0.89) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL13946243 | 0.84 | CYP1A2 (0.67) | TSHRLOXL2KCNJ1KCNH2ALDH1A1 | |
| SCHEMBL267666 | 0.84 | ALDH1A1 (0.70) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL18913824 | 0.84 | TSHR (0.69) | POLBTSHRLOXL2KCNJ1KCNH2 | |
| SCHEMBL30758863 | 0.84 | TSHR (0.69) | POLBTSHRLOXL2KCNJ1KCNH2 |
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-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |