Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ATIC | P31939 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11684034 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1TSHRNPC1WDR5 | |
| 3-Chloroaniline SCHEMBL11685285 | 0.78 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1TSHRPOLBHSD17B10 | |
| 3-Chloroaniline SCHEMBL11682537 | 0.77 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1TSHRNPC1CYP1A2 | |
| Aniline SCHEMBL11683015 | 0.76 | POLB (0.47) | SMN1; SMN2ALDH1A1NPC1CYP1A2CYP3A4 | |
| SCHEMBL11685529 | 0.74 | POLB (0.43) | SMN1; SMN2ALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11682462 | 0.74 | TSHR (0.42) | SMN1; SMN2NPSR1TSHRHPGDHSD17B10 | |
| SCHEMBL11680641 | 0.74 | CYP2C9 (0.48) | SMN1; SMN2ALDH1A1TSHRCYP1A2CYP3A4 | |
| SCHEMBL4548023 | 0.72 | RAB9A (0.58) | NPSR1ALDH1A1USP2TSHRNPC1 | |
| SCHEMBL31330205 | 0.72 | RAPGEF4 (0.47) | SMN1; SMN2ALDH1A1USP2TSHRPKM | |
| SCHEMBL158166 | 0.72 | RAPGEF4 (0.47) | SMN1; SMN2ALDH1A1USP2TSHRPKM |
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-4055557-A | MONOAZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-25 | — | — | US | disclosed |