Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1027644 | 0.79 | VCAM1 (0.57) | ALDH1A1TDP1CRHBPCRHR2MAPT | |
| SCHEMBL9264032 | 0.79 | ALDH1A1 (0.49) | ALDH1A1TDP1CRHBPCRHR2MAPT | |
| SCHEMBL17471721 | 0.78 | TSHR (0.47) | ALDH1A1P2RY6MAPTRAB9ANPC1 | |
| SCHEMBL14002734 | 0.76 | MAPT (0.50) | ALDH1A1TDP1MAPTRAB9APOLB | |
| SCHEMBL14366621 | 0.76 | ALDH1A1 (0.42) | ALDH1A1TDP1CRHBPCRHR2MAPT | |
| SCHEMBL29199363 | 0.75 | P2RY6 (0.43) | ALDH1A1P2RY6MAPTPOLBHPGD | |
| SCHEMBL1063282 | 0.75 | TDP1 (0.50) | ALDH1A1TDP1P2RY6MAPTPOLB | |
| SCHEMBL18980822 | 0.74 | CASP6 (0.47) | TDP1P2RY6MAPTMEN1CASP6 | |
| SCHEMBL3905288 | 0.74 | ALDH1A1 (0.58) | ALDH1A1TDP1CRHBPCRHR2MAPT | |
| SCHEMBL99637 | 0.73 | ALDH1A1 (0.61) | ALDH1A1TDP1CRHBPCRHR2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4219679-A | HIGH CONVERSION | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1980-08-26 | — | — | US | disclosed |
| US-4216341-A | Selective hydrogenation of certain nitroaromatic hydroxy substituted acetylenes over a heterogeneous RuS2 catalyst | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1980-08-05 | — | — | US | disclosed |
| US-4139561-A | RUTHENIUM HYDROGENATION CATALYST | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1979-02-13 | — | — | US | disclosed |