Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9679863 | 0.85 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL9681072 | 0.81 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL9681331 | 0.80 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL17324777 | 0.80 | HPGD (0.55) | ALDH1A1SMN1; SMN2HPGDNPC1PKM | |
| SCHEMBL3667774 | 0.80 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL10458798 | 0.79 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL22355416 | 0.79 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 | |
| SCHEMBL12205867 | 0.78 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2TSHRMAPK1ACHE | |
| SCHEMBL9679431 | 0.76 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2TSHRMAPK1ACHE | |
| SCHEMBL10458497 | 0.76 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2TSHRMAPK1HRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5145885-A | Morpholine compound, binders | CIBA-GEIGY CORPORATION (US) | 1992-09-08 | — | — | US | disclosed |
| US-4992547-A | Aminoaryl ketone photoinitiators | CIBA-GEIGY CORPORATION (US) | 1991-02-12 | — | — | US | disclosed |