Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | UBE2N | P61088 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11587901 | 0.83 | MEP1B (0.46) | ALDH1A1GAAHTTKMT2ASMN1; SMN2 | |
| SCHEMBL246828 | 0.83 | ALDH1A1 (0.51) | ALDH1A1TSHRGAAUBE2NHTT | |
| SCHEMBL7100004 | 0.82 | GAA (0.49) | ALDH1A1TSHRGAAHTTKMT2A | |
| Water SCHEMBL4808465 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| Water SCHEMBL15452952 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| Hydrochloric Acid SCHEMBL27541968 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| SCHEMBL1639914 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| SCHEMBL9317288 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| SCHEMBL8612082 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT | |
| SCHEMBL28815614 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGAAUBE2NHTT |
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-4571437-A | CATALYTIC HYDROGENATION REDUCTION AND REARRANGEMENT OF NITROBENZENE IN PRESENCE OF SULFUR COMPOUND | MALLINCKRODT, INC. (US) | 1986-02-18 | — | — | US | disclosed |