Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8173618 | 0.88 | ALDH1A1 (0.46) | ALDH1A1ALOX15MAPTCES2CES1 | |
| SCHEMBL9712387 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTCES2CES1GAA | |
| SCHEMBL27321464 | 0.81 | AKR1C3 (0.46) | ALDH1A1ALOX15MAPTGAALMNA | |
| SCHEMBL14454155 | 0.80 | CDK2 (0.48) | ALDH1A1ALOX15MAPTCES2CES1 | |
| SCHEMBL9712460 | 0.79 | BCL2L1 (0.51) | ALDH1A1MAPTKMT2ARAB9AMEN1 | |
| SCHEMBL31611275 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15LMNACYP3A4CYP2C9 | |
| SCHEMBL301550 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15LMNACYP3A4CYP2C9 | |
| SCHEMBL9712456 | 0.78 | GABRA1 (0.42) | ALDH1A1ALOX15RORCCYP3A4CYP2C9 | |
| SCHEMBL9712558 | 0.77 | ALDH1A1 (0.76) | ALDH1A1ALOX15MAPTCES2CES1 | |
| SCHEMBL29766383 | 0.77 | CES2 (0.52) | ALDH1A1ALOX15MAPTCES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5117057-A | Insecticidal N' substituted-N-N'-disubstituted-hydrazines | ROHM AND HAAS COMPANY (US) | 1992-05-26 | — | — | US | disclosed |