Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TLR4 | O00206 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19446499 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL11403417 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL9499238 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL9499234 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL9560726 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL14302793 | 1.00 | NAAA (0.45) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL11403256 | 0.97 | NAAA (0.47) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL10660736 | 0.96 | PKM (0.44) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL9502518 | 0.96 | PKM (0.44) | NAAAPOLBHPGDHTTLMNA | |
| SCHEMBL9502512 | 0.96 | PKM (0.44) | NAAAPOLBHPGDHTTLMNA |
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-5236620-A | 2,3-DIFLUOROBENZENE DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-08-17 | — | — | US | disclosed |
| US-4935160-A | Liquid-crystal guest-host systems | MERCK PATENT GESSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-06-19 | — | — | US | disclosed |