Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10814071 | 0.85 | ALDH1A1 (0.63) | ALDH1A1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL10444573 | 0.82 | TSHR (0.47) | ALDH1A1KDM4EMAPTTDP1KMT2A | |
| SCHEMBL11749607 | 0.82 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1TDP1KMT2A | |
| SCHEMBL10444365 | 0.80 | MDM2 (0.45) | ALDH1A1RAB9AHPGDNPC1MAPT | |
| SCHEMBL5533042 | 0.80 | ALDH1A1 (0.69) | ALDH1A1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL11754313 | 0.79 | KMT2A (0.55) | ALDH1A1RAB9AHPGDNPC1MAPT | |
| SCHEMBL11754053 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL11748687 | 0.76 | ALDH1A1 (0.59) | ALDH1A1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL11748782 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL11752709 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4ERAB9AHPGDNPC1 |
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-4051250-A | OXAZOLE, THIAZOLE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-09-27 | — | — | US | disclosed |
| US-3933840-A | ANTIPHLOGISTIC | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1976-01-20 | — | — | US | disclosed |