Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | GLA | P06280 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| Triphenylene SCHEMBL28213011 | 0.79 | ALDH1A1 (0.83) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL4972293 | 0.75 | ALDH1A1 (1.00) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL3045498 | 0.75 | ALDH1A1 (1.00) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL29352289 | 0.75 | ALDH1A1 (1.00) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL8339 | 0.75 | ALDH1A1 (1.00) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL1772714 | 0.75 | ALDH1A1 (1.00) | ALDH1A1HPGDGLAMAPTACHE | |
| Phenanthrene SCHEMBL27653554 | 0.75 | ALDH1A1 (0.75) | ALDH1A1HPGDGLAMAPTACHE | |
| SCHEMBL30438089 | 0.74 | ALDH1A1 (0.58) | ALDH1A1HPGDGLAMAPTACHE | |
| Anthracene SCHEMBL9879830 | 0.73 | MAPT (0.94) | ALDH1A1HPGDGLAMAPTACHE | |
| Acridine SCHEMBL618814 | 0.73 | ALDH1A1 (0.94) | ALDH1A1HPGDGLAMAPTACHE |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5545736-A | INHIBITORS OF REVERSE TRANSCROPTASE AND ANTIRETROVIRAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-08-13 | — | — | US | claimed |
| EP-0544169-B1 | 6-thiono-5,6-dihydro-dibenz[b,e]azepin-11-ono-oximes and their use as retroviral agents | BAYER AG (DE) | 1994-11-17 | — | — | EP | claimed |
| EP-0544169-A1 | 6-thiono-5,6-dihydro-dibenz[b,e]azepin-11-ono-oximes and their use as retroviral agents | BAYER AG (DE) | 1993-06-02 | — | — | EP | claimed |
| US-5545736-A | INHIBITORS OF REVERSE TRANSCROPTASE AND ANTIRETROVIRAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-08-13 | — | — | US | disclosed |
| US-5545736-A | INHIBITORS OF REVERSE TRANSCROPTASE AND ANTIRETROVIRAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-08-13 | — | — | US | disclosed |
| EP-0544169-B1 | 6-thiono-5,6-dihydro-dibenz[b,e]azepin-11-ono-oximes and their use as retroviral agents | BAYER AG (DE) | 1994-11-17 | — | — | EP | disclosed |
| EP-0544169-A1 | 6-thiono-5,6-dihydro-dibenz[b,e]azepin-11-ono-oximes and their use as retroviral agents | BAYER AG (DE) | 1993-06-02 | — | — | EP | disclosed |
| EP-0544169-A1 | 6-thiono-5,6-dihydro-dibenz[b,e]azepin-11-ono-oximes and their use as retroviral agents | BAYER AG (DE) | 1993-06-02 | — | — | EP | disclosed |