Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of Valine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.75 |
| ▸ | SLC1A3 | P43003 | 10/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 10/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 9/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | FAP | Q12884 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Valine SCHEMBL9376703 | 1.00 | SLC7A5 (0.75) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL27873291 | 0.92 | SLC7A5 (0.79) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL247489 | 0.92 | SLC7A5 (0.79) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL247488 | 0.92 | SLC7A5 (0.79) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL28174038 | 0.90 | SLC7A5 (0.75) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL28174037 | 0.90 | SLC7A5 (0.75) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL28174036 | 0.90 | SLC7A5 (0.75) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL7397892 | 0.88 | SLC7A5 (0.71) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL9205010 | 0.88 | SLC7A5 (0.71) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 | |
| Valine SCHEMBL974879 | 0.87 | SLC7A5 (0.79) | SLC7A5SLC1A3SLC1A2SLC1A1PMP22 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180256717-A1 | PROTEIN COMPOSITIONS AND USE THEREOF | DRUG DISCOVERY LABORATORY AS (NO) | 2018-09-13 | — | — | US | disclosed |
| EP-3236942-A1 | PROTEIN COMPOSITIONS AND USE THEREOF | Drug Discovery Laboratory AS (NO) | 2017-11-01 | — | — | EP | disclosed |
| WO-2016103034-A1 | PROTEIN COMPOSITIONS AND USE THEREOF | DRUG DISCOVERY LABORATORY AS (NO) | 2016-06-30 | — | — | WO | disclosed |