Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 2/20 | 0.64 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.55 |
| ▸ | UNG | P13051 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 3/20 | 0.43 |
| ▸ | RXRA | P19793 | 2/20 | 0.42 |
| ▸ | RXRB | P28702 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16434649 | 0.84 | UNG (0.61) | TPMTHCAR1UNGALDH1A1TTR | |
| SCHEMBL3470017 | 0.84 | UNG (0.61) | TPMTUNGALDH1A1TTRTSHR | |
| SCHEMBL8979359 | 0.83 | TPMT (0.41) | TPMTHCAR1UNGALDH1A1HCAR2 | |
| SCHEMBL23699 | 0.79 | TPMT (1.00) | TPMTHCAR1ALDH1A1HCAR2TTR | |
| SCHEMBL28214359 | 0.79 | TPMT (1.00) | TPMTHCAR1ALDH1A1HCAR2TTR | |
| SCHEMBL69625 | 0.79 | TPMT (0.89) | TPMTHCAR1ALDH1A1HCAR2TTR | |
| SCHEMBL29639671 | 0.79 | TPMT (0.57) | TPMTHCAR1UNGALDH1A1HCAR2 | |
| SCHEMBL17049781 | 0.78 | UNG (0.55) | TPMTUNGALDH1A1TTRTSHR | |
| SCHEMBL17049785 | 0.78 | UNG (0.55) | TPMTUNGALDH1A1TSHRALOX15 | |
| SCHEMBL2556774 | 0.78 | RXRA (0.61) | TPMTHCAR1UNGALDH1A1RXRA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021050688-A1 | COMPOUNDS AND USES THEREOF | X-CHEM, INC. (US) | 2021-03-18 | — | — | WO | disclosed |
| WO-2021050688-A1 | COMPOUNDS AND USES THEREOF | X-CHEM, INC. (US) | 2021-03-18 | — | — | WO | disclosed |
| EP-0604019-B1 | N-Acetonylbenzamides and their use as fungicides | ROHM & HAAS (US) | 1996-05-08 | — | — | EP | disclosed |
| EP-0604019-A1 | N-Acetonylbenzamides and their use as fungicides | ROHM AND HAAS COMPANY (US) | 1994-06-29 | — | — | EP | disclosed |
| US-5254584-A | Controlling phytopathogens | ROHM AND HAAS COMPANY (US) | 1993-10-19 | — | — | US | disclosed |