Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | TDP2 | O95551 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | METAP1 | P53582 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16879344 | 0.89 | TDP1 (0.49) | PDK2TRPA1TDP2TDP1L3MBTL1 | |
| SCHEMBL16878998 | 0.86 | TDP1 (0.50) | PDK2TRPA1TDP2TDP1L3MBTL1 | |
| SCHEMBL31613856 | 0.86 | TDP1 (0.46) | PDK2TRPA1TDP2TDP1L3MBTL1 | |
| SCHEMBL29399278 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL783450 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL29397249 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL29574412 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL996751 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL783463 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 | |
| SCHEMBL29530902 | 0.83 | PDK2 (0.58) | PDK2TDP2TDP1L3MBTL1CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3172775-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2022-04-20 | — | — | EP | disclosed |
| US-9691989-B2 | Carbo- and heterocyclic spiro compounds as donor materials for organic photovoltaics and their preparation | THE UNIVERSITY OF HONG KONG (CN) | 2017-06-27 | — | — | US | disclosed |
| US-9691989-B2 | Carbo- and heterocyclic spiro compounds as donor materials for organic photovoltaics and their preparation | THE UNIVERSITY OF HONG KONG (CN) | 2017-06-27 | — | — | US | disclosed |
| WO-2016023458-A1 | NOVEL CARBO- AND HETEROCYCLIC SPIRO COMPOUNDS AS DONOR MATERIALS FOR ORGANIC PHOTOVOLTAICS AND THEIR PREPARATION | THE UNIVERSITY OF HONG KONG (CN) | 2016-02-18 | — | — | WO | disclosed |