Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 4/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.34 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL3742961 | 0.78 | THRB (0.42) | ALDH1A1TSHRNPC1RAB9AMAPT | |
| SCHEMBL10685105 | 0.75 | POLB (0.41) | ALDH1A1TSHRMAPTCYP3A4KCNJ1 | |
| SCHEMBL12824158 | 0.75 | THRB (0.48) | ALDH1A1TSHRNPC1RAB9AMAPT | |
| SCHEMBL366594 | 0.73 | ALDH1A1 (0.48) | ALDH1A1TSHRNPC1RAB9AMAPT | |
| SCHEMBL5724597 | 0.72 | ERN1 (0.46) | ALDH1A1TSHRKCNJ1THRBTDP1 | |
| SCHEMBL3065272 | 0.72 | ERN1 (0.46) | ALDH1A1TSHRMAPTTHRBTDP1 | |
| SCHEMBL27468138 | 0.72 | MAPT (0.38) | ALDH1A1NPC1RAB9AMAPTPKM | |
| SCHEMBL4353272 | 0.72 | ALDH1A1 (0.50) | ALDH1A1TSHRRXFP1CYP1A2CYP3A4 | |
| SCHEMBL29818681 | 0.72 | ALDH1A1 (0.50) | ALDH1A1TSHRRXFP1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL28212658 | 0.72 | ALDH1A1 (0.46) | ALDH1A1TSHRNPC1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998014442-A1 | CHIRAL COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-09 | — | — | WO | disclosed |