Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 10/20 | 0.36 |
| ▸ | CA12 | O43570 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | CA9 | Q16790 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10411687 | 0.89 | CA2 (0.50) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL7622316 | 0.83 | CTDSP1 (0.37) | HSD17B10ALDH1A1CA2GAAMAPT | |
| SCHEMBL6029167 | 0.81 | HSD17B10 (0.45) | MMP2MMP14HSD17B10ALDH1A1CA2 | |
| SCHEMBL10411983 | 0.81 | HSD17B10 (0.41) | MMP2MMP14HSD17B10ALDH1A1CA2 | |
| SCHEMBL8899784 | 0.80 | GAA (0.46) | MMP2MMP14ALDH1A1CA2CA12 | |
| SCHEMBL11670052 | 0.80 | ALDH1A1 (0.41) | MMP2MMP14HSD17B10ALDH1A1GAA | |
| SCHEMBL10673232 | 0.80 | CA1 (0.51) | MMP2ALDH1A1CA2CA1GAA | |
| SCHEMBL9809412 | 0.78 | ALDH1A1 (0.47) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL10596598 | 0.78 | ALDH1A1 (0.41) | HSD17B10ALDH1A1GAAMAPTKDM4E | |
| SCHEMBL9809401 | 0.78 | CA2 (0.49) | HSD17B10ALDH1A1CA2GAAMAPT |
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-4939243-A | Water-soluble copper complex disazo compounds containg a chloro triazinylamino group and a group of the vinylsulfone series as fiber-reactive groups and their dyestuffs | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-07-03 | — | — | US | disclosed |