Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | HTR1B | P28222 | 2/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PRNP | P04156 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15486127 | 0.84 | MEN1 (0.56) | SIRT1CHUKARMEN1KMT2A | |
| SCHEMBL11810570 | 0.82 | KIF11 (0.57) | PARP1HTR1BMEN1KMT2ARAB9A | |
| SCHEMBL1180875 | 0.81 | KDM4E (0.59) | MEN1KMT2ARAB9AHTR7HSD17B10 | |
| SCHEMBL29643250 | 0.81 | KDM4E (0.59) | MEN1KMT2ARAB9AHTR7HSD17B10 | |
| SCHEMBL16709582 | 0.79 | KIF11 (0.62) | PARP1HTR1BMEN1KMT2ANPC1 | |
| SCHEMBL25658280 | 0.79 | HTR1B (0.46) | PARP1HTR1BMEN1KMT2ARAB9A | |
| SCHEMBL29366993 | 0.79 | CHUK (0.64) | CHUKARCYP1A2HSD17B10PRNP | |
| SCHEMBL38602 | 0.79 | CHUK (0.64) | CHUKARCYP1A2HSD17B10PRNP | |
| Hydrochloric Acid SCHEMBL8594443 | 0.78 | KDM4E (0.56) | MEN1KMT2ARAB9AHTR7HSD17B10 | |
| Hydrochloric Acid SCHEMBL8594438 | 0.78 | KDM4E (0.56) | MEN1KMT2ARAB9AHTR7HSD17B10 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9243281-B2 | Neuroprotective chemicals and methods for identifying and using same | BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2016-01-26 | — | — | US | disclosed |
| US-9243281-B2 | Neuroprotective chemicals and methods for identifying and using same | BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2016-01-26 | — | — | US | disclosed |
| US-20150132783-A1 | Neuroprotective Chemicals and Methods for Identifying and Using Same | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2015-05-14 | — | — | US | disclosed |
| US-20150132783-A1 | Neuroprotective Chemicals and Methods for Identifying and Using Same | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2015-05-14 | — | — | US | disclosed |
| WO-2015070237-A1 | NEUROPROTECTIVE CHEMICALS AND METHODS FOR IDENTIFYING AND USING SAME | BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-05-14 | — | — | WO | disclosed |