Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NT5E | P21589 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.38 |
| ▸ | SENP2 | Q9HC62 | 6/20 | 0.37 |
| ▸ | SENP3 | Q9H4L4 | 5/20 | 0.37 |
| ▸ | SENP1 | Q9P0U3 | 5/20 | 0.37 |
| ▸ | SUMO2 | P61956 | 4/20 | 0.37 |
| ▸ | SUMO1 | P63165 | 4/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATIC | P31939 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | SNCA | P37840 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL11684505 | 0.82 | PTPN11 (0.39) | ALDH1A1TSHRHSD17B10TDP1ENPP2 | |
| Aniline SCHEMBL11685584 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10TDP1NT5E | |
| SCHEMBL11684850 | 0.79 | TP53 (0.41) | ALDH1A1TSHRHSD17B10SENP2SENP3 | |
| 3-Chloroaniline SCHEMBL11687359 | 0.77 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10TDP1NT5E | |
| Aniline SCHEMBL11683907 | 0.77 | CYP2D6 (0.54) | ALDH1A1TSHRHSD17B10TDP1NT5E | |
| Aniline SCHEMBL11682873 | 0.76 | TSHR (0.56) | ALDH1A1TSHRHSD17B10TDP1NT5E | |
| O-Tolylamine SCHEMBL11682944 | 0.75 | PHLPP2 (0.38) | ALDH1A1TSHRHSD17B10TDP1ENPP2 | |
| SCHEMBL11679955 | 0.74 | TSHR (0.37) | ALDH1A1TSHRHSD17B10TDP1ENPP2 | |
| SCHEMBL8746224 | 0.73 | RPS6KA3 (0.54) | ALDH1A1TSHRHSD17B10NT5EENPP2 | |
| SCHEMBL9178619 | 0.73 | RPS6KA3 (0.54) | ALDH1A1TSHRHSD17B10NT5EENPP2 |
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 |