Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.68 |
| ▸ | LMNA | P02545 | 4/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.68 |
| ▸ | MEN1 | O00255 | 3/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.68 |
| ▸ | HTT | P42858 | 2/20 | 0.68 |
| ▸ | MAPT | P10636 | 2/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17857333 | 0.90 | MEN1 (0.60) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL11045241 | 0.89 | ALDH1A1 (0.87) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL17857335 | 0.87 | ALDH1A1 (0.56) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL24947871 | 0.82 | ALDH1A1 (0.58) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL17857330 | 0.79 | CYP1A2 (0.62) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL15801282 | 0.79 | CYP1A2 (0.66) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL16174405 | 0.79 | CYP1A2 (0.66) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL12180774 | 0.79 | CYP1A2 (0.66) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL28346875 | 0.78 | LMNA (0.64) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL11911904 | 0.78 | ALDH1A1 (0.71) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016097657-A2 | POLYAROMATIC DIMERS, METHOD FOR PREPARING SAME AND USE OF SAME | CENTRE DE COOPÉRATION INTERNATIONAL EN RECHERCHE AGRONOMIQUE POUR LE DÉVELOPPEMENT (CIRAD) (FR) | 2016-06-23 | — | — | WO | disclosed |