Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15216575 | 0.93 | MAPT (0.58) | SLC6A2SLC6A4SLC6A3L3MBTL1MAPT | |
| SCHEMBL3695529 | 0.89 | ALDH1A1 (0.62) | L3MBTL1MAPTCYP1A2CYP3A4TSHR | |
| SCHEMBL10038669 | 0.85 | ALDH1A1 (0.60) | SLC6A2SLC6A4SLC6A3L3MBTL1MAPT | |
| SCHEMBL1047553 | 0.81 | MAPT (0.70) | L3MBTL1MAPTCYP1A2CYP3A4TSHR | |
| SCHEMBL733008 | 0.79 | SLC6A3 (1.00) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL257695 | 0.79 | L3MBTL1 (0.56) | L3MBTL1MAPTCYP3A4MAPK1ALDH1A1 | |
| SCHEMBL5663512 | 0.77 | ALDH1A1 (0.62) | L3MBTL1MAPTCYP1A2CYP3A4TSHR | |
| Ammonia Solution, Strong SCHEMBL5999715 | 0.77 | SLC6A3 (0.95) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL4048052 | 0.76 | ALDH1A1 (0.51) | L3MBTL1MAPTCYP1A2CYP3A4TSHR | |
| SCHEMBL19334711 | 0.76 | ALDH1A1 (0.60) | L3MBTL1MAPTCYP1A2CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2630481-B1 | A method and kit for detecting alkylating agents | UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) | 2017-09-13 | — | — | EP | disclosed |
| US-20130224876-A1 | A METHOD AND DEVICE FOR DETECTING ALKYLATING AGENTS | Univeristy College Cardiff Consultants Limited | 2013-08-29 | — | — | US | disclosed |
| US-20130224876-A1 | A METHOD AND DEVICE FOR DETECTING ALKYLATING AGENTS | Univeristy College Cardiff Consultants Limited | 2013-08-29 | — | — | US | disclosed |