Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 7/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | BDKRB2 | P30411 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10800514 | 0.87 | ALDH1A1 (0.49) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL6658753 | 0.87 | ALDH1A1 (0.55) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL29113362 | 0.86 | LMNA (0.54) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL10884804 | 0.84 | KMT2A (0.47) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL9700188 | 0.84 | RARB (0.53) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL23866983 | 0.83 | LOXL2 (0.51) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL17272969 | 0.83 | BDKRB2 (0.44) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL153634 | 0.82 | BDKRB2 (0.48) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL9487423 | 0.82 | LMNA (0.56) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL11658538 | 0.81 | RARB (0.60) | ALDH1A1BDKRB2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1592729-A | Process for preparing pentacene derivatives | 3M INNOVATIVE PROPERTIES CO (US) | 2005-03-09 | — | — | CN | disclosed |
| CN-1582506-A | Substituted pentacene semiconductors | 3M INNOVATIVE PROPERTIES CO (US) | 2005-02-16 | — | — | CN | disclosed |
| EP-1433211-A2 | SUBSTITUTED PENTACENE SEMICONDUCTORS | 3M Innovative Properties Company (US) | 2004-06-30 | — | — | EP | disclosed |
| EP-1430008-A2 | PROCESS FOR PREPARING PENTACENE DERIVATIVES | 3M Innovative Properties Company (US) | 2004-06-23 | — | — | EP | disclosed |
| WO-2003028125-A2 | SUBSTITUTED PENTACENE SEMICONDUCTORS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2003-04-03 | — | — | WO | disclosed |
| WO-2003027050-A2 | PROCESS FOR PREPARING PENTACENE DERIVATIVES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2003-04-03 | — | — | WO | disclosed |