Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GCGR | P47871 | 1/20 | 0.42 |
| ▸ | GIPR | P48546 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL12407047 | 0.86 | TRPV1 (0.61) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| Hydrochloric Acid SCHEMBL2173185 | 0.86 | TRPV1 (0.60) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL2173461 | 0.84 | TRPV1 (0.58) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL283213 | 0.83 | TRPV1 (0.58) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL2171406 | 0.77 | SMN1; SMN2 (0.57) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL5670028 | 0.76 | IGF1R (0.56) | HIF1ASMN1; SMN2HTTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL2173104 | 0.76 | SMN1; SMN2 (0.56) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL2171648 | 0.76 | TRPV1 (0.56) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL2173445 | 0.75 | TRPV1 (0.53) | TRPV1HIF1ASMN1; SMN2HTTNPC1 | |
| SCHEMBL2186611 | 0.74 | TRPV1 (0.48) | TRPV1SMN1; SMN2HTTNPC1RAB9A |
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-7973061-B2 | Anaplastic lymphoma kinase modulators and methods of use | EXELIXIS, INC. (US) | 2011-07-05 | — | — | US | disclosed |