Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21239901 | 0.78 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3OPRL1TP53 | |
| SCHEMBL28273316 | 0.78 | SLC6A4 (0.51) | SLC6A4SLC6A2SLC6A3 | |
| Hydrogen Peroxide SCHEMBL11527807 | 0.75 | SLC6A4 (0.56) | SLC6A4SLC6A2SLC6A3AKR1C1HDAC4 | |
| SCHEMBL22871222 | 0.75 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3OPRL1TP53 | |
| SCHEMBL12235288 | 0.75 | SLC6A3 (0.71) | SLC6A4SLC6A2SLC6A3TP53CYP3A4 | |
| SCHEMBL8655542 | 0.73 | SLC6A4 (0.54) | SLC6A4SLC6A2SLC6A3AKR1C1HDAC4 | |
| SCHEMBL28302871 | 0.73 | TAAR1 (0.45) | SLC6A4SLC6A2SLC6A3TDP1OPRL1 | |
| SCHEMBL6228602 | 0.73 | OPRM1 (0.40) | SLC6A4SLC6A2SLC6A3TDP1SMN1; SMN2 | |
| SCHEMBL27262560 | 0.73 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3OPRL1OPRM1 | |
| SCHEMBL27671441 | 0.72 | SLC6A4 (0.58) | SLC6A4SLC6A2SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |
| US-6248755-B1 | ANTIINFLAMMATORY AGENTS; ANTIALLERGENS; AUTOIMMUNE DISEASES | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |