Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.53 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21950895 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL16732318 | 0.80 | TSHR (0.54) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL8975464 | 0.80 | TSHR (0.54) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL9863046 | 0.80 | TSHR (0.54) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL16732313 | 0.80 | TSHR (0.54) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28412415 | 0.79 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28412005 | 0.79 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28891457 | 0.79 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28417766 | 0.79 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28409062 | 0.79 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4841003-A | CCODINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, HALOGEN, LEWIS BASE AND ORGANOALUMINUM COMPOUNDS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-06-20 | — | — | US | claimed |
| US-5075396-A | Coordination catalyst comprising magnesium, titanium, halogen, aluminum, an organosilicon compound and a heterocyclic diester as electron donor; durability; stereospecific | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-12-24 | — | — | US | disclosed |
| EP-0115195-B1 | CATALYST COMPOSITION FOR USE IN THE POLYMERIZATION OF OLEFINS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1990-09-26 | — | — | EP | disclosed |
| US-4841003-A | CCODINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, HALOGEN, LEWIS BASE AND ORGANOALUMINUM COMPOUNDS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-06-20 | — | — | US | disclosed |
| US-4725656-A | COORDINATION CATALYST COMPRISING MAGNESIUM TITANIUM, ALUMINUM, ORGANO SILICON COMPOUNDS, AND POLYESTERS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1988-02-16 | — | — | US | disclosed |
| EP-0115195-A1 | Catalyst composition for use in the polymerization of olefins | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1984-08-08 | — | — | EP | disclosed |