Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29952361 | 0.76 | LIPE (0.47) | ALDH1A1RAB9APOLBTP53LMNA | |
| SCHEMBL29956910 | 0.76 | ALDH1A1 (0.41) | ALDH1A1RAB9APOLBMAPTSMN1; SMN2 | |
| SCHEMBL29951557 | 0.75 | RAB9A (0.43) | ALDH1A1RAB9APOLBTP53LMNA | |
| SCHEMBL29950694 | 0.75 | CXCR2 (0.40) | ALDH1A1RAB9APOLBMAPTSMN1; SMN2 | |
| Methyl Alcohol SCHEMBL29261078 | 0.74 | CYP2C19 (0.56) | ALDH1A1RAB9ATP53LMNAMAPT | |
| SCHEMBL29956655 | 0.74 | CXCR2 (0.40) | ALDH1A1RAB9APOLBLMNAMAPT | |
| SCHEMBL29955289 | 0.73 | CXCR2 (0.39) | ALDH1A1RAB9ALMNASMN1; SMN2NPC1 | |
| SCHEMBL2560549 | 0.72 | CXCR2 (0.43) | RAB9ATP53LMNAMAPTSMN1; SMN2 | |
| SCHEMBL902030 | 0.71 | IDO1 (0.34) | SMN1; SMN2LIPEKDM4E | |
| SCHEMBL15330371 | 0.70 | TAAR1 (0.45) | ALDH1A1LMNAMAPTSMN1; SMN2TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |