Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 9/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8920031 | 0.84 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2GAATDP1MAPT | |
| SCHEMBL4193744 | 0.82 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2GAATDP1MAPT | |
| SCHEMBL8924099 | 0.79 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2GAATDP1MAPT | |
| SCHEMBL8920797 | 0.77 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2MAPTPOLBLMNA | |
| SCHEMBL1028661 | 0.75 | KDM4E (0.48) | ALDH1A1SMN1; SMN2GAAMAPTPOLB | |
| SCHEMBL8920042 | 0.74 | POLB (0.45) | ALDH1A1SMN1; SMN2GAAMAPTPOLB | |
| SCHEMBL8922426 | 0.74 | PKM (0.40) | ALDH1A1SMN1; SMN2TDP1MAPTLMNA | |
| SCHEMBL9089099 | 0.72 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2GAATDP1MAPT | |
| SCHEMBL2930475 | 0.72 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2GAATDP1MAPT | |
| SCHEMBL1073892 | 0.70 | PKM (0.44) | ALDH1A1SMN1; SMN2TDP1MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5663366-A | Process for the synthesis of 4,5-diaminopyrazole derivatives useful for dyeing hair | WELLA AKTIENGESELLSCHAT (DE) | 1997-09-02 | — | — | US | disclosed |
| EP-0618902-A1 | PROCESS FOR PRODUCING 4,5-DIAMINO PYRAZOLE DERIVATIVES, THEIR USE FOR COLOURING HAIR AND NOVEL PYRAZOLE DERIVATIVES | Wella Aktiengesellschaft (DE) | 1994-10-12 | — | — | EP | disclosed |
| WO-1994008969-A1 | PROCESS FOR PRODUCING 4,5-DIAMINO PYRAZOLE DERIVATIVES, THEIR USE FOR COLOURING HAIR AND NOVEL PYRAZOLE DERIVATIVES | WELLA AKTIENGESELLSCHAFT (DE) | 1994-04-28 | — | — | WO | disclosed |