Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5183522 | 0.80 | RAB9A (0.46) | SLC6A4RAB9ASMN1; SMN2HPGDTSHR | |
| SCHEMBL22254877 | 0.80 | SLC6A4 (0.52) | SLC6A4RAB9ASMN1; SMN2ACACBCYP1A2 | |
| SCHEMBL22255193 | 0.80 | SLC6A4 (0.52) | SLC6A4RAB9ASMN1; SMN2ACACBCYP1A2 | |
| SCHEMBL22254879 | 0.80 | SLC6A4 (0.52) | SLC6A4RAB9ASMN1; SMN2ACACBCYP1A2 | |
| SCHEMBL29022785 | 0.77 | SLC6A4 (0.66) | SLC6A4ACACBSIGMAR1 | |
| Hydrochloric Acid SCHEMBL1813541 | 0.76 | SLC6A4 (0.64) | SLC6A4ACACBSIGMAR1APEX1PMP22 | |
| SCHEMBL12404709 | 0.76 | SIGMAR1 (0.62) | SLC6A4RAB9ASMN1; SMN2HPGDACACB | |
| SCHEMBL18211455 | 0.74 | CYP1A2 (0.68) | SLC6A4ACACBCYP1A2CYP2D6SIGMAR1 | |
| SCHEMBL8268047 | 0.72 | TSHR (0.59) | RAB9ASMN1; SMN2HPGDTSHRHTT | |
| SCHEMBL178625 | 0.71 | TAAR1 (0.65) | SLC6A4ACACBCYP2D6SIGMAR1 |
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-7985882-B1 | Compositions for reductive aminations utilizing supported tricarboxyborohydride reagents and methods of using the same | BIOTAGE AB (SE) | 2011-07-26 | — | — | US | disclosed |